2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide

C295H285Br8Cl9F35N39O31S2 — CID 158546496

IUPAC2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide
SMILESCC(=O)NCc1ccc(Cl)c(Cc2nc3cc(C(=O)Nc4ccc(Br)cc4)c(OCC(F)F)cc3n2C)c1.CC1CCC(NC(=O)c2cc3nc(Cc4cc(CNC(=O)C5(C(F)(F)F)CC5)c(F)cc4Cl)n(C)c3cc2OCC(F)F)CC1.CCOc1cc2c(cc1C(=O)CCC1CC1)nc(Cc1cc(CNC(=O)C(C)(C)C)ccc1Cl)n2C.Cn1c(Cc2cc(CNC(=O)C(C)(C)C)ccc2Cl)nc2c1=CC(OCC(F)F)C(C(=O)Nc1ccc(Br)cc1)C=2.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)c(F)cc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2C(F)(F)F)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNS(=O)(=O)C(C)(C)C)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNS(=O)C(C)(C)C)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21
InChIInChI=1S/C31H25BrF8N4O3.C31H33ClF6N4O3.C30H24BrClF6N4O3.C30H25BrClF5N4O3.C30H32BrClF2N4O3.C29H30BrClF2N4O4S.C29H30BrClF2N4O3S.C29H26BrClF2N4O3.C29H36ClN3O3.C27H24BrClF2N4O3/c1-44-23-13-24(47-15-25(33)34)20(27(45)42-19-5-3-18(32)4-6-19)12-22(23)43-26(44)11-17-10-16(2-7-21(17)30(35,36)37)14-41-28(46)29(8-9-29)31(38,39)40;1-16-3-5-19(6-4-16)40-28(43)20-11-23-24(13-25(20)45-15-26(34)35)42(2)27(41-23)10-17-9-18(22(33)12-21(17)32)14-39-29(44)30(7-8-30)31(36,37)38;1-42-23-12-24(45-14-25(34)35)19(27(43)40-18-4-2-17(31)3-5-18)10-22(23)41-26(42)9-15-8-16(21(33)11-20(15)32)13-39-28(44)29(6-7-29)30(36,37)38;1-41-23-13-24(44-15-25(33)34)20(27(42)39-19-5-3-18(31)4-6-19)12-22(23)40-26(41)11-17-10-16(2-7-21(17)32)14-38-28(43)29(8-9-29)30(35,36)37;1-30(2,3)29(40)35-15-17-5-10-22(32)18(11-17)12-27-37-23-13-21(28(39)36-20-8-6-19(31)7-9-20)25(41-16-26(33)34)14-24(23)38(27)4;1-29(2,3)42(39,40)34-15-17-5-10-22(31)18(11-17)12-27-36-23-13-21(28(38)35-20-8-6-19(30)7-9-20)25(41-16-26(32)33)14-24(23)37(27)4;1-29(2,3)41(39)34-15-17-5-10-22(31)18(11-17)12-27-36-23-13-21(28(38)35-20-8-6-19(30)7-9-20)25(40-16-26(32)33)14-24(23)37(27)4;1-37-24-13-25(40-15-26(32)33)21(29(39)35-20-7-5-19(30)6-8-20)12-23(24)36-27(37)11-18-10-16(2-9-22(18)31)14-34-28(38)17-3-4-17;1-6-36-26-16-24-23(15-21(26)25(34)12-10-18-7-8-18)32-27(33(24)5)14-20-13-19(9-11-22(20)30)17-31-28(35)29(2,3)4;1-15(36)32-13-16-3-8-21(29)17(9-16)10-26-34-22-11-20(27(37)33-19-6-4-18(28)5-7-19)24(38-14-25(30)31)12-23(22)35(26)2/h2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,41,46)(H,42,45);9,11-13,16,19,26H,3-8,10,14-15H2,1-2H3,(H,39,44)(H,40,43);2-5,8,10-12,25H,6-7,9,13-14H2,1H3,(H,39,44)(H,40,43);2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,38,43)(H,39,42);5-11,13-14,21,25-26H,12,15-16H2,1-4H3,(H,35,40)(H,36,39);5-11,13-14,26,34H,12,15-16H2,1-4H3,(H,35,38);5-11,13-14,26,34H,12,15-16H2,1-4H3,(H,35,38);2,5-10,12-13,17,26H,3-4,11,14-15H2,1H3,(H,34,38)(H,35,39);9,11,13,15-16,18H,6-8,10,12,14,17H2,1-5H3,(H,31,35);3-9,11-12,25H,10,13-14H2,1-2H3,(H,32,36)(H,33,37)
InChIKeyHPEGECTUFOZSPQ-UHFFFAOYSA-N
MW6560.14 g/mol
LogP66.83
Rot. Bonds98

About 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide

2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide (PubChem CID 158546496) has the molecular formula C295H285Br8Cl9F35N39O31S2 and a molecular weight of 6560.14 g/mol. Its IUPAC name is 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide.

Molecular Properties

Compound Name2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide
PubChem CID158546496
Molecular FormulaC295H285Br8Cl9F35N39O31S2
Molecular Weight6560.14 g/mol
Exact Mass6544.15
IUPAC Name2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide
SMILESCC(=O)NCc1ccc(Cl)c(Cc2nc3cc(C(=O)Nc4ccc(Br)cc4)c(OCC(F)F)cc3n2C)c1.CC1CCC(NC(=O)c2cc3nc(Cc4cc(CNC(=O)C5(C(F)(F)F)CC5)c(F)cc4Cl)n(C)c3cc2OCC(F)F)CC1.CCOc1cc2c(cc1C(=O)CCC1CC1)nc(Cc1cc(CNC(=O)C(C)(C)C)ccc1Cl)n2C.Cn1c(Cc2cc(CNC(=O)C(C)(C)C)ccc2Cl)nc2c1=CC(OCC(F)F)C(C(=O)Nc1ccc(Br)cc1)C=2.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)c(F)cc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2C(F)(F)F)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNS(=O)(=O)C(C)(C)C)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNS(=O)C(C)(C)C)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21
InChIInChI=1S/C31H25BrF8N4O3.C31H33ClF6N4O3.C30H24BrClF6N4O3.C30H25BrClF5N4O3.C30H32BrClF2N4O3.C29H30BrClF2N4O4S.C29H30BrClF2N4O3S.C29H26BrClF2N4O3.C29H36ClN3O3.C27H24BrClF2N4O3/c1-44-23-13-24(47-15-25(33)34)20(27(45)42-19-5-3-18(32)4-6-19)12-22(23)43-26(44)11-17-10-16(2-7-21(17)30(35,36)37)14-41-28(46)29(8-9-29)31(38,39)40;1-16-3-5-19(6-4-16)40-28(43)20-11-23-24(13-25(20)45-15-26(34)35)42(2)27(41-23)10-17-9-18(22(33)12-21(17)32)14-39-29(44)30(7-8-30)31(36,37)38;1-42-23-12-24(45-14-25(34)35)19(27(43)40-18-4-2-17(31)3-5-18)10-22(23)41-26(42)9-15-8-16(21(33)11-20(15)32)13-39-28(44)29(6-7-29)30(36,37)38;1-41-23-13-24(44-15-25(33)34)20(27(42)39-19-5-3-18(31)4-6-19)12-22(23)40-26(41)11-17-10-16(2-7-21(17)32)14-38-28(43)29(8-9-29)30(35,36)37;1-30(2,3)29(40)35-15-17-5-10-22(32)18(11-17)12-27-37-23-13-21(28(39)36-20-8-6-19(31)7-9-20)25(41-16-26(33)34)14-24(23)38(27)4;1-29(2,3)42(39,40)34-15-17-5-10-22(31)18(11-17)12-27-36-23-13-21(28(38)35-20-8-6-19(30)7-9-20)25(41-16-26(32)33)14-24(23)37(27)4;1-29(2,3)41(39)34-15-17-5-10-22(31)18(11-17)12-27-36-23-13-21(28(38)35-20-8-6-19(30)7-9-20)25(40-16-26(32)33)14-24(23)37(27)4;1-37-24-13-25(40-15-26(32)33)21(29(39)35-20-7-5-19(30)6-8-20)12-23(24)36-27(37)11-18-10-16(2-9-22(18)31)14-34-28(38)17-3-4-17;1-6-36-26-16-24-23(15-21(26)25(34)12-10-18-7-8-18)32-27(33(24)5)14-20-13-19(9-11-22(20)30)17-31-28(35)29(2,3)4;1-15(36)32-13-16-3-8-21(29)17(9-16)10-26-34-22-11-20(27(37)33-19-6-4-18(28)5-7-19)24(38-14-25(30)31)12-23(22)35(26)2/h2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,41,46)(H,42,45);9,11-13,16,19,26H,3-8,10,14-15H2,1-2H3,(H,39,44)(H,40,43);2-5,8,10-12,25H,6-7,9,13-14H2,1H3,(H,39,44)(H,40,43);2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,38,43)(H,39,42);5-11,13-14,21,25-26H,12,15-16H2,1-4H3,(H,35,40)(H,36,39);5-11,13-14,26,34H,12,15-16H2,1-4H3,(H,35,38);5-11,13-14,26,34H,12,15-16H2,1-4H3,(H,35,38);2,5-10,12-13,17,26H,3-4,11,14-15H2,1H3,(H,34,38)(H,35,39);9,11,13,15-16,18H,6-8,10,12,14,17H2,1-5H3,(H,31,35);3-9,11-12,25H,10,13-14H2,1-2H3,(H,32,36)(H,33,37)
InChIKeyHPEGECTUFOZSPQ-UHFFFAOYSA-N
XLogP66.83
TPSA857.54 Ų
H-Bond Donors19
H-Bond Acceptors51
Rotatable Bonds98
Heavy Atoms419
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006560.14
LogP ≤ 566.83
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1051

Analyze 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide?
The IUPAC name of 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide (CID 158546496) is 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide.
What is the SMILES notation for 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide?
The canonical SMILES for 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide is CC(=O)NCc1ccc(Cl)c(Cc2nc3cc(C(=O)Nc4ccc(Br)cc4)c(OCC(F)F)cc3n2C)c1.CC1CCC(NC(=O)c2cc3nc(Cc4cc(CNC(=O)C5(C(F)(F)F)CC5)c(F)cc4Cl)n(C)c3cc2OCC(F)F)CC1.CCOc1cc2c(cc1C(=O)CCC1CC1)nc(Cc1cc(CNC(=O)C(C)(C)C)ccc1Cl)n2C.Cn1c(Cc2cc(CNC(=O)C(C)(C)C)ccc2Cl)nc2c1=CC(OCC(F)F)C(C(=O)Nc1ccc(Br)cc1)C=2.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)c(F)cc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2C(F)(F)F)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNS(=O)(=O)C(C)(C)C)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNS(=O)C(C)(C)C)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.
What is the InChIKey of 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide?
The InChIKey is HPEGECTUFOZSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H25BrF8N4O3.C31H33ClF6N4O3.C30H24BrClF6N4O3.C30H25BrClF5N4O3.C30H32BrClF2N4O3.C29H30BrClF2N4O4S.C29H30BrClF2N4O3S.C29H26BrClF2N4O3.C29H36ClN3O3.C27H24BrClF2N4O3/c1-44-23-13-24(47-15-25(33)34)20(27(45)42-19-5-3-18(32)4-6-19)12-22(23)43-26(44)11-17-10-16(2-7-21(17)30(35,36)37)14-41-28(46)29(8-9-29)31(38,39)40;1-16-3-5-19(6-4-16)40-28(43)20-11-23-24(13-25(20)45-15-26(34)35)42(2)27(41-23)10-17-9-18(22(33)12-21(17)32)14-39-29(44)30(7-8-30)31(36,37)38;1-42-23-12-24(45-14-25(34)35)19(27(43)40-18-4-2-17(31)3-5-18)10-22(23)41-26(42)9-15-8-16(21(33)11-20(15)32)13-39-28(44)29(6-7-29)30(36,37)38;1-41-23-13-24(44-15-25(33)34)20(27(42)39-19-5-3-18(31)4-6-19)12-22(23)40-26(41)11-17-10-16(2-7-21(17)32)14-38-28(43)29(8-9-29)30(35,36)37;1-30(2,3)29(40)35-15-17-5-10-22(32)18(11-17)12-27-37-23-13-21(28(39)36-20-8-6-19(31)7-9-20)25(41-16-26(33)34)14-24(23)38(27)4;1-29(2,3)42(39,40)34-15-17-5-10-22(31)18(11-17)12-27-36-23-13-21(28(38)35-20-8-6-19(30)7-9-20)25(41-16-26(32)33)14-24(23)37(27)4;1-29(2,3)41(39)34-15-17-5-10-22(31)18(11-17)12-27-36-23-13-21(28(38)35-20-8-6-19(30)7-9-20)25(40-16-26(32)33)14-24(23)37(27)4;1-37-24-13-25(40-15-26(32)33)21(29(39)35-20-7-5-19(30)6-8-20)12-23(24)36-27(37)11-18-10-16(2-9-22(18)31)14-34-28(38)17-3-4-17;1-6-36-26-16-24-23(15-21(26)25(34)12-10-18-7-8-18)32-27(33(24)5)14-20-13-19(9-11-22(20)30)17-31-28(35)29(2,3)4;1-15(36)32-13-16-3-8-21(29)17(9-16)10-26-34-22-11-20(27(37)33-19-6-4-18(28)5-7-19)24(38-14-25(30)31)12-23(22)35(26)2/h2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,41,46)(H,42,45);9,11-13,16,19,26H,3-8,10,14-15H2,1-2H3,(H,39,44)(H,40,43);2-5,8,10-12,25H,6-7,9,13-14H2,1H3,(H,39,44)(H,40,43);2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,38,43)(H,39,42);5-11,13-14,21,25-26H,12,15-16H2,1-4H3,(H,35,40)(H,36,39);5-11,13-14,26,34H,12,15-16H2,1-4H3,(H,35,38);5-11,13-14,26,34H,12,15-16H2,1-4H3,(H,35,38);2,5-10,12-13,17,26H,3-4,11,14-15H2,1H3,(H,34,38)(H,35,39);9,11,13,15-16,18H,6-8,10,12,14,17H2,1-5H3,(H,31,35);3-9,11-12,25H,10,13-14H2,1-2H3,(H,32,36)(H,33,37).
What are the key properties of 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide?
2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide has a molecular weight of 6560.14 g/mol, XLogP of 66.83, 98 rotatable bonds, 19 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(acetamidomethyl)-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfinylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[5-[(tert-butylsulfonylamino)methyl]-2-chlorophenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(cyclopropanecarbonylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-dimethylpropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-5,6-dihydrobenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methyl-2-[[2-(trifluoromethyl)-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]benzimidazole-5-carboxamide;N-[[4-chloro-3-[[5-(3-cyclopropylpropanoyl)-6-ethoxy-1-methylbenzimidazol-2-yl]methyl]phenyl]methyl]-2,2-dimethylpropanamide;2-[[2-chloro-4-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4-methylcyclohexyl)benzimidazole-5-carboxamide is sourced from PubChem (CID 158546496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).