N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide

C281H258Br5Cl9F48N40O29 — CID 157150335

IUPACN-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide
SMILESCC(CCC(C)(F)F)NC(=O)c1cc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)n(C)c2cc1OCC(F)F.COc1cc2c(cc1C(=O)NCC1CC1)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.COc1cc2c(cc1C(=O)Nc1ccc(Br)cc1)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.COc1cc2c(cc1C(N)=O)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)NCC3CC3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)NCCCC(F)(F)F)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)C3(C(F)(F)F)CC3)ccc2F)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.O=C(NC1=CC=C(Br)CC1)c1cc2[nH]c(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)nc2cc1OCC(F)F.O=C(Nc1ccc(Br)cc1)c1ccc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)[nH]c2c1
InChIInChI=1S/C30H25BrClF5N4O3.C30H25BrF6N4O3.C30H32ClF7N4O3.C29H25BrClF5N4O3.C29H25BrClF3N4O3.C28H27ClF8N4O3.C28H28ClF5N4O3.C27H21BrClF3N4O2.C27H28ClF3N4O3.C23H22ClF3N4O3/c2*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;1-16(6-7-28(2,34)35)40-26(43)19-12-21-22(13-23(19)45-15-24(32)33)42(3)25(41-21)11-18-10-17(4-5-20(18)31)14-39-27(44)29(8-9-29)30(36,37)38;30-17-2-4-18(5-3-17)38-26(41)19-11-21-22(12-23(19)43-14-24(32)33)40-25(39-21)10-16-9-15(1-6-20(16)31)13-37-27(42)28(7-8-28)29(34,35)36;1-38-23-14-24(41-2)20(26(39)36-19-6-4-18(30)5-7-19)13-22(23)37-25(38)12-17-11-16(3-8-21(17)31)15-35-27(40)28(9-10-28)29(32,33)34;1-41-20-12-21(44-14-22(30)31)17(24(42)38-8-2-5-27(32,33)34)11-19(20)40-23(41)10-16-9-15(3-4-18(16)29)13-39-25(43)26(6-7-26)28(35,36)37;1-38-21-11-22(41-14-23(30)31)18(25(39)35-12-15-2-3-15)10-20(21)37-24(38)9-17-8-16(4-5-19(17)29)13-36-26(40)27(6-7-27)28(32,33)34;28-18-3-5-19(6-4-18)34-24(37)16-2-8-21-22(12-16)36-23(35-21)13-17-11-15(1-7-20(17)29)14-33-25(38)26(9-10-26)27(30,31)32;1-35-21-12-22(38-2)18(24(36)32-13-15-3-4-15)11-20(21)34-23(35)10-17-9-16(5-6-19(17)28)14-33-25(37)26(7-8-26)27(29,30)31;1-31-17-10-18(34-2)14(20(28)32)9-16(17)30-19(31)8-13-7-12(3-4-15(13)24)11-29-21(33)22(5-6-22)23(25,26)27/h2*2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,38,43)(H,39,42);4-5,10,12-13,16,24H,6-9,11,14-15H2,1-3H3,(H,39,44)(H,40,43);1-2,4,6,9,11-12,24H,3,5,7-8,10,13-14H2,(H,37,42)(H,38,41)(H,39,40);3-8,11,13-14H,9-10,12,15H2,1-2H3,(H,35,40)(H,36,39);3-4,9,11-12,22H,2,5-8,10,13-14H2,1H3,(H,38,42)(H,39,43);4-5,8,10-11,15,23H,2-3,6-7,9,12-14H2,1H3,(H,35,39)(H,36,40);1-8,11-12H,9-10,13-14H2,(H,33,38)(H,34,37)(H,35,36);5-6,9,11-12,15H,3-4,7-8,10,13-14H2,1-2H3,(H,32,36)(H,33,37);3-4,7,9-10H,5-6,8,11H2,1-2H3,(H2,28,32)(H,29,33)
InChIKeyALEIZIFOMVAMDG-UHFFFAOYSA-N
MW6289.91 g/mol
LogP62.87
Rot. Bonds97

About N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide

N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide (PubChem CID 157150335) has the molecular formula C281H258Br5Cl9F48N40O29 and a molecular weight of 6289.91 g/mol. Its IUPAC name is N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide
PubChem CID157150335
Molecular FormulaC281H258Br5Cl9F48N40O29
Molecular Weight6289.91 g/mol
Exact Mass6277.23
IUPAC NameN-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide
SMILESCC(CCC(C)(F)F)NC(=O)c1cc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)n(C)c2cc1OCC(F)F.COc1cc2c(cc1C(=O)NCC1CC1)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.COc1cc2c(cc1C(=O)Nc1ccc(Br)cc1)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.COc1cc2c(cc1C(N)=O)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)NCC3CC3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)NCCCC(F)(F)F)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)C3(C(F)(F)F)CC3)ccc2F)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.O=C(NC1=CC=C(Br)CC1)c1cc2[nH]c(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)nc2cc1OCC(F)F.O=C(Nc1ccc(Br)cc1)c1ccc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)[nH]c2c1
InChIInChI=1S/C30H25BrClF5N4O3.C30H25BrF6N4O3.C30H32ClF7N4O3.C29H25BrClF5N4O3.C29H25BrClF3N4O3.C28H27ClF8N4O3.C28H28ClF5N4O3.C27H21BrClF3N4O2.C27H28ClF3N4O3.C23H22ClF3N4O3/c2*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;1-16(6-7-28(2,34)35)40-26(43)19-12-21-22(13-23(19)45-15-24(32)33)42(3)25(41-21)11-18-10-17(4-5-20(18)31)14-39-27(44)29(8-9-29)30(36,37)38;30-17-2-4-18(5-3-17)38-26(41)19-11-21-22(12-23(19)43-14-24(32)33)40-25(39-21)10-16-9-15(1-6-20(16)31)13-37-27(42)28(7-8-28)29(34,35)36;1-38-23-14-24(41-2)20(26(39)36-19-6-4-18(30)5-7-19)13-22(23)37-25(38)12-17-11-16(3-8-21(17)31)15-35-27(40)28(9-10-28)29(32,33)34;1-41-20-12-21(44-14-22(30)31)17(24(42)38-8-2-5-27(32,33)34)11-19(20)40-23(41)10-16-9-15(3-4-18(16)29)13-39-25(43)26(6-7-26)28(35,36)37;1-38-21-11-22(41-14-23(30)31)18(25(39)35-12-15-2-3-15)10-20(21)37-24(38)9-17-8-16(4-5-19(17)29)13-36-26(40)27(6-7-27)28(32,33)34;28-18-3-5-19(6-4-18)34-24(37)16-2-8-21-22(12-16)36-23(35-21)13-17-11-15(1-7-20(17)29)14-33-25(38)26(9-10-26)27(30,31)32;1-35-21-12-22(38-2)18(24(36)32-13-15-3-4-15)11-20(21)34-23(35)10-17-9-16(5-6-19(17)28)14-33-25(37)26(7-8-26)27(29,30)31;1-31-17-10-18(34-2)14(20(28)32)9-16(17)30-19(31)8-13-7-12(3-4-15(13)24)11-29-21(33)22(5-6-22)23(25,26)27/h2*2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,38,43)(H,39,42);4-5,10,12-13,16,24H,6-9,11,14-15H2,1-3H3,(H,39,44)(H,40,43);1-2,4,6,9,11-12,24H,3,5,7-8,10,13-14H2,(H,37,42)(H,38,41)(H,39,40);3-8,11,13-14H,9-10,12,15H2,1-2H3,(H,35,40)(H,36,39);3-4,9,11-12,22H,2,5-8,10,13-14H2,1H3,(H,38,42)(H,39,43);4-5,8,10-11,15,23H,2-3,6-7,9,12-14H2,1H3,(H,35,39)(H,36,40);1-8,11-12H,9-10,13-14H2,(H,33,38)(H,34,37)(H,35,36);5-6,9,11-12,15H,3-4,7-8,10,13-14H2,1-2H3,(H,32,36)(H,33,37);3-4,7,9-10H,5-6,8,11H2,1-2H3,(H2,28,32)(H,29,33)
InChIKeyALEIZIFOMVAMDG-UHFFFAOYSA-N
XLogP62.87
TPSA878.98 Ų
H-Bond Donors22
H-Bond Acceptors47
Rotatable Bonds97
Heavy Atoms412
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006289.91
LogP ≤ 562.87
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1047

Analyze N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-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 N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide?
The IUPAC name of N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide (CID 157150335) is N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide.
What is the SMILES notation for N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide?
The canonical SMILES for N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide is CC(CCC(C)(F)F)NC(=O)c1cc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)n(C)c2cc1OCC(F)F.COc1cc2c(cc1C(=O)NCC1CC1)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.COc1cc2c(cc1C(=O)Nc1ccc(Br)cc1)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.COc1cc2c(cc1C(N)=O)nc(Cc1cc(CNC(=O)C3(C(F)(F)F)CC3)ccc1Cl)n2C.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)NCC3CC3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)NCCCC(F)(F)F)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)C3(C(F)(F)F)CC3)ccc2F)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.O=C(NC1=CC=C(Br)CC1)c1cc2[nH]c(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)nc2cc1OCC(F)F.O=C(Nc1ccc(Br)cc1)c1ccc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)[nH]c2c1.
What is the InChIKey of N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide?
The InChIKey is ALEIZIFOMVAMDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25BrClF5N4O3.C30H25BrF6N4O3.C30H32ClF7N4O3.C29H25BrClF5N4O3.C29H25BrClF3N4O3.C28H27ClF8N4O3.C28H28ClF5N4O3.C27H21BrClF3N4O2.C27H28ClF3N4O3.C23H22ClF3N4O3/c2*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;1-16(6-7-28(2,34)35)40-26(43)19-12-21-22(13-23(19)45-15-24(32)33)42(3)25(41-21)11-18-10-17(4-5-20(18)31)14-39-27(44)29(8-9-29)30(36,37)38;30-17-2-4-18(5-3-17)38-26(41)19-11-21-22(12-23(19)43-14-24(32)33)40-25(39-21)10-16-9-15(1-6-20(16)31)13-37-27(42)28(7-8-28)29(34,35)36;1-38-23-14-24(41-2)20(26(39)36-19-6-4-18(30)5-7-19)13-22(23)37-25(38)12-17-11-16(3-8-21(17)31)15-35-27(40)28(9-10-28)29(32,33)34;1-41-20-12-21(44-14-22(30)31)17(24(42)38-8-2-5-27(32,33)34)11-19(20)40-23(41)10-16-9-15(3-4-18(16)29)13-39-25(43)26(6-7-26)28(35,36)37;1-38-21-11-22(41-14-23(30)31)18(25(39)35-12-15-2-3-15)10-20(21)37-24(38)9-17-8-16(4-5-19(17)29)13-36-26(40)27(6-7-27)28(32,33)34;28-18-3-5-19(6-4-18)34-24(37)16-2-8-21-22(12-16)36-23(35-21)13-17-11-15(1-7-20(17)29)14-33-25(38)26(9-10-26)27(30,31)32;1-35-21-12-22(38-2)18(24(36)32-13-15-3-4-15)11-20(21)34-23(35)10-17-9-16(5-6-19(17)28)14-33-25(37)26(7-8-26)27(29,30)31;1-31-17-10-18(34-2)14(20(28)32)9-16(17)30-19(31)8-13-7-12(3-4-15(13)24)11-29-21(33)22(5-6-22)23(25,26)27/h2*2-7,10,12-13,25H,8-9,11,14-15H2,1H3,(H,38,43)(H,39,42);4-5,10,12-13,16,24H,6-9,11,14-15H2,1-3H3,(H,39,44)(H,40,43);1-2,4,6,9,11-12,24H,3,5,7-8,10,13-14H2,(H,37,42)(H,38,41)(H,39,40);3-8,11,13-14H,9-10,12,15H2,1-2H3,(H,35,40)(H,36,39);3-4,9,11-12,22H,2,5-8,10,13-14H2,1H3,(H,38,42)(H,39,43);4-5,8,10-11,15,23H,2-3,6-7,9,12-14H2,1H3,(H,35,39)(H,36,40);1-8,11-12H,9-10,13-14H2,(H,33,38)(H,34,37)(H,35,36);5-6,9,11-12,15H,3-4,7-8,10,13-14H2,1-2H3,(H,32,36)(H,33,37);3-4,7,9-10H,5-6,8,11H2,1-2H3,(H2,28,32)(H,29,33).
What are the key properties of N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide?
N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide has a molecular weight of 6289.91 g/mol, XLogP of 62.87, 97 rotatable bonds, 22 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromocyclohexa-1,3-dien-1-yl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-3H-benzimidazole-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)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-2-[[2-fluoro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-methoxy-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-N-(5,5-difluorohexan-2-yl)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methyl-N-(4,4,4-trifluorobutyl)benzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-1-methylbenzimidazole-5-carboxamide is sourced from PubChem (CID 157150335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).