2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride

C293H260Br9Cl11F38N42O30 — CID 159017994

IUPAC2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride
SMILESCC(C(=O)NCc1ccc(Cl)c(Cc2nc3cc(C(=O)Nc4ccc(Br)cc4)c(OCC(F)F)cc3n2C)c1)C(F)(F)F.CN(C)CCn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)ccc21.COCCn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)ccc21.COc1cc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)[nH]c2cc1C(=O)Nc1ccc(Br)cc1.Cn1c(Cc2cc(CNC(=O)C(C)(C)C(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C(C)(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C(C)(N)C(F)(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(O)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)c3c(F)cccc3Cl)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.F.O=C(NCC1CC1)c1cc2[nH]c(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)nc2cc1OCC(F)F
InChIInChI=1S/C32H24BrCl2F3N4O3.C31H30BrClF3N5O2.C30H28BrClF4N4O3.C30H27BrClF3N4O3.C29H26BrClF5N5O3.C29H25BrClF5N4O3.C29H26BrClF2N4O4.C28H24BrClF4N4O3.C28H23BrClF3N4O3.C27H26ClF5N4O3.FH/c1-42-26-14-27(45-16-28(37)38)21(31(43)40-20-8-6-19(33)7-9-20)13-25(26)41-29(42)12-18-11-17(5-10-22(18)34)15-39-32(44)30-23(35)3-2-4-24(30)36;1-40(2)13-14-41-26-10-4-20(28(42)38-23-7-5-22(32)6-8-23)16-25(26)39-27(41)17-21-15-19(3-9-24(21)33)18-37-29(43)30(11-12-30)31(34,35)36;1-30(2,28(35)36)29(42)37-14-16-4-9-21(32)17(10-16)11-26-39-22-12-20(27(41)38-19-7-5-18(31)6-8-19)24(43-15-25(33)34)13-23(22)40(26)3;1-42-13-12-39-25-9-3-19(27(40)37-22-6-4-21(31)5-7-22)15-24(25)38-26(39)16-20-14-18(2-8-23(20)32)17-36-28(41)29(10-11-29)30(33,34)35;1-28(37,29(34,35)36)27(43)38-13-15-3-8-20(31)16(9-15)10-25-40-21-11-19(26(42)39-18-6-4-17(30)5-7-18)23(44-14-24(32)33)12-22(21)41(25)2;1-15(29(34,35)36)27(41)37-13-16-3-8-21(31)17(9-16)10-26-39-22-11-20(28(42)38-19-6-4-18(30)5-7-19)24(43-14-25(32)33)12-23(22)40(26)2;1-37-23-13-24(41-15-25(32)33)20(27(38)35-19-5-3-18(30)4-6-19)12-22(23)36-26(37)11-17-10-16(2-7-21(17)31)14-34-28(39)29(40)8-9-29;1-28(33,34)27(40)35-13-15-3-8-20(30)16(9-15)10-25-37-21-11-19(26(39)36-18-6-4-17(29)5-7-18)23(41-14-24(31)32)12-22(21)38(25)2;1-40-23-13-22-21(12-19(23)25(38)35-18-5-3-17(29)4-6-18)36-24(37-22)11-16-10-15(2-7-20(16)30)14-34-26(39)27(8-9-27)28(31,32)33;28-18-4-3-15(12-35-25(39)26(5-6-26)27(31,32)33)7-16(18)8-23-36-19-9-17(24(38)34-11-14-1-2-14)21(10-20(19)37-23)40-13-22(29)30;/h2-11,13-14,28H,12,15-16H2,1H3,(H,39,44)(H,40,43);3-10,15-16H,11-14,17-18H2,1-2H3,(H,37,43)(H,38,42);4-10,12-13,25,28H,11,14-15H2,1-3H3,(H,37,42)(H,38,41);2-9,14-15H,10-13,16-17H2,1H3,(H,36,41)(H,37,40);3-9,11-12,24H,10,13-14,37H2,1-2H3,(H,38,43)(H,39,42);3-9,11-12,15,25H,10,13-14H2,1-2H3,(H,37,41)(H,38,42);2-7,10,12-13,25,40H,8-9,11,14-15H2,1H3,(H,34,39)(H,35,38);3-9,11-12,24H,10,13-14H2,1-2H3,(H,35,40)(H,36,39);2-7,10,12-13H,8-9,11,14H2,1H3,(H,34,39)(H,35,38)(H,36,37);3-4,7,9-10,14,22H,1-2,5-6,8,11-13H2,(H,34,38)(H,35,39)(H,36,37);1H
InChIKeyJTIFBDMFXSRPEJ-UHFFFAOYSA-N
MW6680.61 g/mol
LogP67.82
Rot. Bonds100

About 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride

2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride (PubChem CID 159017994) has the molecular formula C293H260Br9Cl11F38N42O30 and a molecular weight of 6680.61 g/mol. Its IUPAC name is 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride.

Molecular Properties

Compound Name2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride
PubChem CID159017994
Molecular FormulaC293H260Br9Cl11F38N42O30
Molecular Weight6680.61 g/mol
Exact Mass6662.87
IUPAC Name2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride
SMILESCC(C(=O)NCc1ccc(Cl)c(Cc2nc3cc(C(=O)Nc4ccc(Br)cc4)c(OCC(F)F)cc3n2C)c1)C(F)(F)F.CN(C)CCn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)ccc21.COCCn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)ccc21.COc1cc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)[nH]c2cc1C(=O)Nc1ccc(Br)cc1.Cn1c(Cc2cc(CNC(=O)C(C)(C)C(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C(C)(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C(C)(N)C(F)(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(O)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)c3c(F)cccc3Cl)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.F.O=C(NCC1CC1)c1cc2[nH]c(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)nc2cc1OCC(F)F
InChIInChI=1S/C32H24BrCl2F3N4O3.C31H30BrClF3N5O2.C30H28BrClF4N4O3.C30H27BrClF3N4O3.C29H26BrClF5N5O3.C29H25BrClF5N4O3.C29H26BrClF2N4O4.C28H24BrClF4N4O3.C28H23BrClF3N4O3.C27H26ClF5N4O3.FH/c1-42-26-14-27(45-16-28(37)38)21(31(43)40-20-8-6-19(33)7-9-20)13-25(26)41-29(42)12-18-11-17(5-10-22(18)34)15-39-32(44)30-23(35)3-2-4-24(30)36;1-40(2)13-14-41-26-10-4-20(28(42)38-23-7-5-22(32)6-8-23)16-25(26)39-27(41)17-21-15-19(3-9-24(21)33)18-37-29(43)30(11-12-30)31(34,35)36;1-30(2,28(35)36)29(42)37-14-16-4-9-21(32)17(10-16)11-26-39-22-12-20(27(41)38-19-7-5-18(31)6-8-19)24(43-15-25(33)34)13-23(22)40(26)3;1-42-13-12-39-25-9-3-19(27(40)37-22-6-4-21(31)5-7-22)15-24(25)38-26(39)16-20-14-18(2-8-23(20)32)17-36-28(41)29(10-11-29)30(33,34)35;1-28(37,29(34,35)36)27(43)38-13-15-3-8-20(31)16(9-15)10-25-40-21-11-19(26(42)39-18-6-4-17(30)5-7-18)23(44-14-24(32)33)12-22(21)41(25)2;1-15(29(34,35)36)27(41)37-13-16-3-8-21(31)17(9-16)10-26-39-22-11-20(28(42)38-19-6-4-18(30)5-7-19)24(43-14-25(32)33)12-23(22)40(26)2;1-37-23-13-24(41-15-25(32)33)20(27(38)35-19-5-3-18(30)4-6-19)12-22(23)36-26(37)11-17-10-16(2-7-21(17)31)14-34-28(39)29(40)8-9-29;1-28(33,34)27(40)35-13-15-3-8-20(30)16(9-15)10-25-37-21-11-19(26(39)36-18-6-4-17(29)5-7-18)23(41-14-24(31)32)12-22(21)38(25)2;1-40-23-13-22-21(12-19(23)25(38)35-18-5-3-17(29)4-6-18)36-24(37-22)11-16-10-15(2-7-20(16)30)14-34-26(39)27(8-9-27)28(31,32)33;28-18-4-3-15(12-35-25(39)26(5-6-26)27(31,32)33)7-16(18)8-23-36-19-9-17(24(38)34-11-14-1-2-14)21(10-20(19)37-23)40-13-22(29)30;/h2-11,13-14,28H,12,15-16H2,1H3,(H,39,44)(H,40,43);3-10,15-16H,11-14,17-18H2,1-2H3,(H,37,43)(H,38,42);4-10,12-13,25,28H,11,14-15H2,1-3H3,(H,37,42)(H,38,41);2-9,14-15H,10-13,16-17H2,1H3,(H,36,41)(H,37,40);3-9,11-12,24H,10,13-14,37H2,1-2H3,(H,38,43)(H,39,42);3-9,11-12,15,25H,10,13-14H2,1-2H3,(H,37,41)(H,38,42);2-7,10,12-13,25,40H,8-9,11,14-15H2,1H3,(H,34,39)(H,35,38);3-9,11-12,24H,10,13-14H2,1-2H3,(H,35,40)(H,36,39);2-7,10,12-13H,8-9,11,14H2,1H3,(H,34,39)(H,35,38)(H,36,37);3-4,7,9-10,14,22H,1-2,5-6,8,11-13H2,(H,34,38)(H,35,39)(H,36,37);1H
InChIKeyJTIFBDMFXSRPEJ-UHFFFAOYSA-N
XLogP67.82
TPSA914.48 Ų
H-Bond Donors24
H-Bond Acceptors50
Rotatable Bonds100
Heavy Atoms423
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006680.61
LogP ≤ 567.82
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1050

Analyze 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride?
The IUPAC name of 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride (CID 159017994) is 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride.
What is the SMILES notation for 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride?
The canonical SMILES for 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride is CC(C(=O)NCc1ccc(Cl)c(Cc2nc3cc(C(=O)Nc4ccc(Br)cc4)c(OCC(F)F)cc3n2C)c1)C(F)(F)F.CN(C)CCn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)ccc21.COCCn1c(Cc2cc(CNC(=O)C3(C(F)(F)F)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)ccc21.COc1cc2nc(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)[nH]c2cc1C(=O)Nc1ccc(Br)cc1.Cn1c(Cc2cc(CNC(=O)C(C)(C)C(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C(C)(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C(C)(N)C(F)(F)F)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)C3(O)CC3)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.Cn1c(Cc2cc(CNC(=O)c3c(F)cccc3Cl)ccc2Cl)nc2cc(C(=O)Nc3ccc(Br)cc3)c(OCC(F)F)cc21.F.O=C(NCC1CC1)c1cc2[nH]c(Cc3cc(CNC(=O)C4(C(F)(F)F)CC4)ccc3Cl)nc2cc1OCC(F)F.
What is the InChIKey of 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride?
The InChIKey is JTIFBDMFXSRPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24BrCl2F3N4O3.C31H30BrClF3N5O2.C30H28BrClF4N4O3.C30H27BrClF3N4O3.C29H26BrClF5N5O3.C29H25BrClF5N4O3.C29H26BrClF2N4O4.C28H24BrClF4N4O3.C28H23BrClF3N4O3.C27H26ClF5N4O3.FH/c1-42-26-14-27(45-16-28(37)38)21(31(43)40-20-8-6-19(33)7-9-20)13-25(26)41-29(42)12-18-11-17(5-10-22(18)34)15-39-32(44)30-23(35)3-2-4-24(30)36;1-40(2)13-14-41-26-10-4-20(28(42)38-23-7-5-22(32)6-8-23)16-25(26)39-27(41)17-21-15-19(3-9-24(21)33)18-37-29(43)30(11-12-30)31(34,35)36;1-30(2,28(35)36)29(42)37-14-16-4-9-21(32)17(10-16)11-26-39-22-12-20(27(41)38-19-7-5-18(31)6-8-19)24(43-15-25(33)34)13-23(22)40(26)3;1-42-13-12-39-25-9-3-19(27(40)37-22-6-4-21(31)5-7-22)15-24(25)38-26(39)16-20-14-18(2-8-23(20)32)17-36-28(41)29(10-11-29)30(33,34)35;1-28(37,29(34,35)36)27(43)38-13-15-3-8-20(31)16(9-15)10-25-40-21-11-19(26(42)39-18-6-4-17(30)5-7-18)23(44-14-24(32)33)12-22(21)41(25)2;1-15(29(34,35)36)27(41)37-13-16-3-8-21(31)17(9-16)10-26-39-22-11-20(28(42)38-19-6-4-18(30)5-7-19)24(43-14-25(32)33)12-23(22)40(26)2;1-37-23-13-24(41-15-25(32)33)20(27(38)35-19-5-3-18(30)4-6-19)12-22(23)36-26(37)11-17-10-16(2-7-21(17)31)14-34-28(39)29(40)8-9-29;1-28(33,34)27(40)35-13-15-3-8-20(30)16(9-15)10-25-37-21-11-19(26(39)36-18-6-4-17(29)5-7-18)23(41-14-24(31)32)12-22(21)38(25)2;1-40-23-13-22-21(12-19(23)25(38)35-18-5-3-17(29)4-6-18)36-24(37-22)11-16-10-15(2-7-20(16)30)14-34-26(39)27(8-9-27)28(31,32)33;28-18-4-3-15(12-35-25(39)26(5-6-26)27(31,32)33)7-16(18)8-23-36-19-9-17(24(38)34-11-14-1-2-14)21(10-20(19)37-23)40-13-22(29)30;/h2-11,13-14,28H,12,15-16H2,1H3,(H,39,44)(H,40,43);3-10,15-16H,11-14,17-18H2,1-2H3,(H,37,43)(H,38,42);4-10,12-13,25,28H,11,14-15H2,1-3H3,(H,37,42)(H,38,41);2-9,14-15H,10-13,16-17H2,1H3,(H,36,41)(H,37,40);3-9,11-12,24H,10,13-14,37H2,1-2H3,(H,38,43)(H,39,42);3-9,11-12,15,25H,10,13-14H2,1-2H3,(H,37,41)(H,38,42);2-7,10,12-13,25,40H,8-9,11,14-15H2,1H3,(H,34,39)(H,35,38);3-9,11-12,24H,10,13-14H2,1-2H3,(H,35,40)(H,36,39);2-7,10,12-13H,8-9,11,14H2,1H3,(H,34,39)(H,35,38)(H,36,37);3-4,7,9-10,14,22H,1-2,5-6,8,11-13H2,(H,34,38)(H,35,39)(H,36,37);1H.
What are the key properties of 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride?
2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride has a molecular weight of 6680.61 g/mol, XLogP of 67.82, 100 rotatable bonds, 24 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-[[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]-2-chlorophenyl]methyl]-N-(4-bromophenyl)-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3-difluoro-2,2-dimethylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[(2,2-difluoropropanoylamino)methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(1-hydroxycyclopropanecarbonyl)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]-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-6-methoxy-3H-benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-1-(2-methoxyethyl)benzimidazole-5-carboxamide;N-(4-bromophenyl)-2-[[2-chloro-5-[[(3,3,3-trifluoro-2-methylpropanoyl)amino]methyl]phenyl]methyl]-6-(2,2-difluoroethoxy)-1-methylbenzimidazole-5-carboxamide;2-[[2-chloro-5-[[[1-(trifluoromethyl)cyclopropanecarbonyl]amino]methyl]phenyl]methyl]-N-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)-3H-benzimidazole-5-carboxamide;hydrofluoride is sourced from PubChem (CID 159017994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).