Molecular Design and Synthesis of Wettability Alteration Chemicals

2014 ◽  
Vol 884-885 ◽  
pp. 96-99
Author(s):  
Ming Hui Zhou ◽  
Wen Jie Sun

Many gas-condensate reservoirs experience a sharp drop in gas production owing to condensation near the wellbore as pressure drops lower than the dew point. It has been a challenge for a long time to develop cheaper chemical to stop the dramatic decline in gas production. In this study several molecule formulas are designed, properties of two chemicals for wettability alteration are predicted using molecular modeling method and then synthesized. Analysis result shows high conformity between the prediction and experimental properties.

2013 ◽  
Vol 2013 ◽  
pp. 1-8 ◽  
Author(s):  
Yan-ling Wang ◽  
Li Ma ◽  
Bao-jun Bai ◽  
Guan-cheng Jiang ◽  
Jia-feng Jin ◽  
...  

Liquid condensation in the reservoir near a wellbore may kill gas production in gas-condensate reservoirs when pressure drops lower than the dew point. It is clear from investigations reported in the literature that gas production could be improved by altering the rock wettability from liquid-wetness to gas-wetness. In this paper, three different fluorosurfactants FG1105, FC911, and FG40 were evaluated for altering the wettability of sandstone rocks from liquid-wetting to gas-wetting using contact angle measurement. The results showed that FG40 provided the best wettability alteration effect with a concentration of 0.3% and FC911 at the concentration of 0.3%.


Author(s):  
Asghar Davood ◽  
Aneseh Rahimi ◽  
Maryam Iman ◽  
Parisa Azerang ◽  
Soroush Sardari ◽  
...  

Objective(s): Azole antifungal agents, which are widely used as antifungal antibiotics, inhibit cytochrome P450 sterol 14α-demethylase (CYP51). Nearly all azole antifungal agents are N-substituted azoles. In addition, an azolylphenalkyl pharmacophore is uniquely shared by all azole antifungals. Due to importance of nitrogen atom of azoles (N-3 of imidazole and N-4 of triazole) in coordination with heme in the binding site of the enzyme, here a group of N- un-substituted azoles in which both of nitrogen is un-substituted was reported. Materials and Methods: Designed compounds were synthesized by reaction of imidazole-4-carboxaldehyde with appropriate arylamines and subsequently reduced to desired amine derivatives. Antifungal activity against Candida albicans and Saccharomyces cervisiae were done using a broth micro-dilution assay. Docking studies were done using AutoDock. Results: Antimicrobial evaluation revealed that some of these compounds exhibited moderate antimicrobial activities against tested pathogenic fungi, wherein compound 3, 7 and 8 were potent. Docking studies propose that all of the prepared azoles interacted with 14α-DM, wherein azole-heme coordination play main role in drug-receptor interaction. Conclusion: Our results offer some useful references in order to molecular design performance or modification of this series of compounds as a lead compound to discover new and potent antimicrobial agents.


2020 ◽  
Vol 30 (6) ◽  
pp. 706-708
Author(s):  
Evgenia V. Nurieva ◽  
Nikolay A. Zefirov ◽  
Nele Fritsch ◽  
Elena R. Milaeva ◽  
Sergei A. Kuznetsov ◽  
...  

2004 ◽  
Vol 126 (1) ◽  
pp. 119-126 ◽  
Author(s):  
F. G. Elliott ◽  
R. Kurz ◽  
C. Etheridge ◽  
J. P. O’Connell

Industrial Gas Turbines allow operation with a wide variety of gaseous and liquid fuels. To determine the suitability for operation with a gas fuel system, various physical parameters of the proposed fuel need to be determined: heating value, dew point, Joule-Thompson coefficient, Wobbe Index, and others. This paper describes an approach to provide a consistent treatment for determining the above physical properties. Special focus is given to the problem of determining the dew point of the potential fuel gas at various pressure levels. A dew point calculation using appropriate equations of state is described, and results are presented. In particular the treatment of heavier hydrocarbons, and water is addressed and recommendations about the necessary data input are made. Since any fuel gas system causes pressure drops in the fuel gas, the temperature reduction due to the Joule-Thompson effect has to be considered and quantified. Suggestions about how to approach fuel suitability questions during the project development and construction phase, as well as in operation are made.


Molecules ◽  
2021 ◽  
Vol 26 (12) ◽  
pp. 3550
Author(s):  
Katharigatta N. Venugopala ◽  
Sandeep Chandrashekharappa ◽  
Christophe Tratrat ◽  
Pran Kishore Deb ◽  
Rahul D. Nagdeve ◽  
...  

The cyclooxygenase-2 (COX-2) enzyme is an important target for drug discovery and development of novel anti-inflammatory agents. Selective COX-2 inhibitors have the advantage of reduced side-effects, which result from COX-1 inhibition that is usually observed with nonselective COX inhibitors. In this study, the design and synthesis of a new series of 7-methoxy indolizines as bioisostere indomethacin analogues (5a–e) were carried out and evaluated for COX-2 enzyme inhibition. All the compounds showed activity in micromolar ranges, and the compound diethyl 3-(4-cyanobenzoyl)-7-methoxyindolizine-1,2-dicarboxylate (5a) emerged as a promising COX-2 inhibitor with an IC50 of 5.84 µM, as compared to indomethacin (IC50 = 6.84 µM). The molecular modeling study of indolizines indicated that hydrophobic interactions were the major contribution to COX-2 inhibition. The title compound diethyl 3-(4-bromobenzoyl)-7-methoxyindolizine-1,2-dicarboxylate (5c) was subjected for single-crystal X-ray studies, Hirshfeld surface analysis, and energy framework calculations. The X-ray diffraction analysis showed that the molecule (5c) crystallizes in the monoclinic crystal system with space group P 21/n with a = 12.0497(6)Å, b = 17.8324(10)Å, c = 19.6052(11)Å, α = 90.000°, β = 100.372(1)°, γ = 90.000°, and V = 4143.8(4)Å3. In addition, with the help of Crystal Explorer software program using the B3LYP/6-31G(d, p) basis set, the theoretical calculation of the interaction and graphical representation of energy value was measured in the form of the energy framework in terms of coulombic, dispersion, and total energy.


RSC Advances ◽  
2013 ◽  
Vol 3 (45) ◽  
pp. 23255 ◽  
Author(s):  
Yousuke Ooyama ◽  
Koji Uenaka ◽  
Ai Matsugasako ◽  
Yutaka Harima ◽  
Joji Ohshita

2013 ◽  
Vol 1 (3) ◽  
pp. 496-513 ◽  
Author(s):  
Rafael Vazquez-Duhalt ◽  
Sergio A. Aguila ◽  
Andrés A. Arrocha ◽  
Marcela Ayala

SPE Journal ◽  
2007 ◽  
Vol 12 (04) ◽  
pp. 397-407 ◽  
Author(s):  
Mashhad Mousa Fahes ◽  
Abbas Firoozabadi

Summary Wettability of two types of sandstone cores, Berea (permeability on the order of 600 md), and a reservoir rock (permeability on the order of 10 md), is altered from liquid-wetting to intermediate gas-wetting at a high temperature of 140C. Previous work on wettability alteration to intermediate gas-wetting has been limited to 90C. In this work, chemicals previously used at 90C for wettability alteration are found to be ineffective at 140C. New chemicals are used which alter wettability at high temperatures. The results show that:wettability could be permanently altered from liquid-wetting to intermediate gas-wetting at high reservoir temperatures,wettability alteration has a substantial effect on increasing liquid mobility at reservoir conditions,wettability alteration results in improved gas productivity, andwettability alteration does not have a measurable effect on the absolute permeability of the rock for some chemicals. We also find the reservoir rock, unlike Berea, is not strongly water-wet in the gas/water/rock system. Introduction A sharp reduction in gas well deliverability is often observed in many low-permeability gas-condensate reservoirs even at very high reservoir pressure. The decrease in well deliverability is attributed to condensate accumulation (Hinchman and Barree 1985; Afidick et al. 1994) and water blocking (Engineer 1985; Cimolai et al. 1983). As the pressure drops below the dewpoint, liquid accumulates around the wellbore in high saturations, reducing gas relative permeability (Barnum et al. 1995; El-Banbi et al. 2000); the result is a decrease in the gas production rate. Several techniques have been used to increase gas well deliverability after the initial decline. Hydraulic fracturing is used to increase absolute permeability (Haimson and Fairhurst 1969). Solvent injection is implemented in order to remove the accumulated liquid (Al-Anazi et al. 2005). Gas deliverability often increases after the reduction of the condensate saturation around the wellbore. In a successful methanol treatment in Hatter's Pond field in Alabama (Al-Anazi et al. 2005), after the initial decline in well deliverability by a factor of three to five owing to condensate blocking, gas deliverability increased by a factor of two after the removal of water and condensate liquids from the near-wellbore region. The increased rates were, however, sustained for a period of 4 months only. The approach is not a permanent solution to the problem, because the condensate bank will form again. On the other hand, when hydraulic fracturing is used by injecting aqueous fluids, the cleanup of water accumulation from the formation after fracturing is essential to obtain an increased productivity. Water is removed in two phases: immiscible displacement by gas, followed by vaporization by the expanding gas flow (Mahadevan and Sharma 2003). Because of the low permeability and the wettability characteristics, it may take a long time to perform the cleanup; in some cases, as little as 10 to 15% of the water load could be recovered (Mahadevan and Sharma 2003; Penny et al. 1983). Even when the problem of water blocking is not significant, the accumulation of condensate around the fracture face when the pressure falls below dewpoint pressure could result in a reduction in the gas production rate (Economides et al. 1989; Sognesand 1991; Baig et al. 2005).


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