2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid

C161H115F26N19O19 — CID 158091934

About 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid

2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid (PubChem CID 158091934) has the molecular formula C161H115F26N19O19 and a molecular weight of 3113.75 g/mol. Its IUPAC name is 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid.

Molecular Properties

• Compound Name: 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid
• PubChem CID: 158091934
• Molecular Formula: C161H115F26N19O19
• Molecular Weight: 3113.75 g/mol
• Exact Mass: 3111.82
• IUPAC Name: 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid
• SMILES: N#Cc1cc(F)c(COc2ccnc(-c3cc(F)c(Cc4nc5ccc(C(=O)O)cc5n4C[C@@H]4CCO4)cc3F)n2)cc1F.N#Cc1ccc(CCc2cccc(-c3cc(F)c(Cc4nc5ccc(C(=O)O)cc5n4C[C@@H]4CCO4)c(F)c3F)n2)c(F)c1.O=C(O)c1ccc2nc(Cc3c(F)cc(-c4cccc(OCc5ccc(C(F)F)cc5F)n4)c(F)c3F)n(CC34CC(CO3)C4)c2c1.O=C(O)c1ccc2nc(Cc3c(F)cc(-c4cccc(OCc5ccc(C(F)F)cc5F)n4)c(F)c3F)n(C[C@@H]3CCO3)c2c1.O=C(O)c1ccc2nc(Cc3cc(F)c(-c4nccc(OCc5ccc(C(F)(F)F)cc5F)n4)cc3F)n(C[C@@H]3CCO3)c2c1
• InChI: InChI=1S/C34H25F6N3O4.C33H24F4N4O3.C32H23F6N3O4.C31H22F6N4O4.C31H21F4N5O4/c35-23-8-18(32(39)40)4-5-20(23)15-46-29-3-1-2-25(42-29)22-10-24(36)21(30(37)31(22)38)11-28-41-26-7-6-19(33(44)45)9-27(26)43(28)16-34-12-17(13-34)14-47-34;34-25-12-18(16-38)4-5-19(25)6-8-21-2-1-3-27(39-21)24-14-26(35)23(31(36)32(24)37)15-30-40-28-9-7-20(33(42)43)13-29(28)41(30)17-22-10-11-44-22;33-22-10-16(31(37)38)4-5-18(22)15-45-28-3-1-2-24(40-28)21-12-23(34)20(29(35)30(21)36)13-27-39-25-7-6-17(32(42)43)11-26(25)41(27)14-19-8-9-44-19;32-22-12-19(31(35,36)37)3-1-17(22)15-45-28-5-7-38-29(40-28)21-13-23(33)18(9-24(21)34)11-27-39-25-4-2-16(30(42)43)10-26(25)41(27)14-20-6-8-44-20;32-22-9-19(23(33)8-18(22)13-36)15-44-29-3-5-37-30(39-29)21-12-24(34)17(7-25(21)35)11-28-38-26-2-1-16(31(41)42)10-27(26)40(28)14-20-4-6-43-20/h1-10,17,32H,11-16H2,(H,44,45);1-5,7,9,12-14,22H,6,8,10-11,15,17H2,(H,42,43);1-7,10-12,19,31H,8-9,13-15H2,(H,42,43);1-5,7,9-10,12-13,20H,6,8,11,14-15H2,(H,42,43);1-3,5,7-10,12,20H,4,6,11,14-15H2,(H,41,42)/t;22-;19-;2*20-/m.0000/s1
• InChIKey: FOFCKCXLYDSHGB-FLIPRNRNSA-N
• XLogP: 33.44
• TPSA: 496.48 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 33
• Rotatable Bonds: 47
• Heavy Atoms: 225
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3113.75
LogP ≤ 5	33.44
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid?

The IUPAC name of 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid (CID 158091934) is 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid.

What is the SMILES notation for 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid?

The canonical SMILES for 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid is N#Cc1cc(F)c(COc2ccnc(-c3cc(F)c(Cc4nc5ccc(C(=O)O)cc5n4C[C@@H]4CCO4)cc3F)n2)cc1F.N#Cc1ccc(CCc2cccc(-c3cc(F)c(Cc4nc5ccc(C(=O)O)cc5n4C[C@@H]4CCO4)c(F)c3F)n2)c(F)c1.O=C(O)c1ccc2nc(Cc3c(F)cc(-c4cccc(OCc5ccc(C(F)F)cc5F)n4)c(F)c3F)n(CC34CC(CO3)C4)c2c1.O=C(O)c1ccc2nc(Cc3c(F)cc(-c4cccc(OCc5ccc(C(F)F)cc5F)n4)c(F)c3F)n(C[C@@H]3CCO3)c2c1.O=C(O)c1ccc2nc(Cc3cc(F)c(-c4nccc(OCc5ccc(C(F)(F)F)cc5F)n4)cc3F)n(C[C@@H]3CCO3)c2c1.

What is the InChIKey of 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid?

The InChIKey is FOFCKCXLYDSHGB-FLIPRNRNSA-N. The full InChI is InChI=1S/C34H25F6N3O4.C33H24F4N4O3.C32H23F6N3O4.C31H22F6N4O4.C31H21F4N5O4/c35-23-8-18(32(39)40)4-5-20(23)15-46-29-3-1-2-25(42-29)22-10-24(36)21(30(37)31(22)38)11-28-41-26-7-6-19(33(44)45)9-27(26)43(28)16-34-12-17(13-34)14-47-34;34-25-12-18(16-38)4-5-19(25)6-8-21-2-1-3-27(39-21)24-14-26(35)23(31(36)32(24)37)15-30-40-28-9-7-20(33(42)43)13-29(28)41(30)17-22-10-11-44-22;33-22-10-16(31(37)38)4-5-18(22)15-45-28-3-1-2-24(40-28)21-12-23(34)20(29(35)30(21)36)13-27-39-25-7-6-17(32(42)43)11-26(25)41(27)14-19-8-9-44-19;32-22-12-19(31(35,36)37)3-1-17(22)15-45-28-5-7-38-29(40-28)21-13-23(33)18(9-24(21)34)11-27-39-25-4-2-16(30(42)43)10-26(25)41(27)14-20-6-8-44-20;32-22-9-19(23(33)8-18(22)13-36)15-44-29-3-5-37-30(39-29)21-12-24(34)17(7-25(21)35)11-28-38-26-2-1-16(31(41)42)10-27(26)40(28)14-20-4-6-43-20/h1-10,17,32H,11-16H2,(H,44,45);1-5,7,9,12-14,22H,6,8,10-11,15,17H2,(H,42,43);1-7,10-12,19,31H,8-9,13-15H2,(H,42,43);1-5,7,9-10,12-13,20H,6,8,11,14-15H2,(H,42,43);1-3,5,7-10,12,20H,4,6,11,14-15H2,(H,41,42)/t;22-;19-;2*20-/m.0000/s1.

What are the key properties of 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid?

2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid has a molecular weight of 3113.75 g/mol, XLogP of 33.44, 47 rotatable bonds, 5 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[4-[4-[(4-cyano-2,5-difluorophenyl)methoxy]pyrimidin-2-yl]-2,5-difluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[2-(4-cyano-2-fluorophenyl)ethyl]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[2,5-difluoro-4-[4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]pyrimidin-2-yl]phenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)benzimidazole-5-carboxylic acid;2-[[4-[6-[[4-(difluoromethyl)-2-fluorophenyl]methoxy]-2-pyridinyl]-2,3,6-trifluorophenyl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid is sourced from PubChem (CID 158091934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).