azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine

C150H140Cl6F10N24O7 — CID 157206478

About azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine

azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine (PubChem CID 157206478) has the molecular formula C150H140Cl6F10N24O7 and a molecular weight of 2793.63 g/mol. Its IUPAC name is azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine.

Molecular Properties

• Compound Name: azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine
• PubChem CID: 157206478
• Molecular Formula: C150H140Cl6F10N24O7
• Molecular Weight: 2793.63 g/mol
• Exact Mass: 2788.93
• IUPAC Name: azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine
• SMILES: CC(=O)N1CCC(C(O)(c2ccc3nc(C(C)(F)F)c(Cc4ccccc4)c(Cl)c3c2)c2cncn2C)CC1.CNC(c1ccc(Cl)cc1)(c1ccc2nc(OC)c(Cc3ccc(-n4cccn4)cc3)c(Cl)c2c1)c1cncn1C.COc1nc2ccc(C(CN)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1Cc1ccc(C(F)(F)F)cc1.COc1nc2ccc(C(N)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc2c(Cl)c1Cc1ccccc1.COc1nc2ccc(C(O)(c3ccc(C)nc3C)C3CNC3)cc2c(Cl)c1Cc1ccc(C(C)(F)F)cc1
• InChI: InChI=1S/C32H28Cl2N6O.C30H28ClF3N6O.C30H31ClF2N4O2.C30H30ClF2N3O2.C28H23ClF3N5O/c1-35-32(29-19-36-20-39(29)2,22-7-10-24(33)11-8-22)23-9-14-28-26(18-23)30(34)27(31(38-28)41-3)17-21-5-12-25(13-6-21)40-16-4-15-37-40;1-17-5-11-24(18(2)37-17)29(16-35,26-15-36-39-40(26)3)21-10-12-25-22(14-21)27(31)23(28(38-25)41-4)13-19-6-8-20(9-7-19)30(32,33)34;1-19(38)37-13-11-21(12-14-37)30(39,26-17-34-18-36(26)3)22-9-10-25-23(16-22)27(31)24(28(35-25)29(2,32)33)15-20-7-5-4-6-8-20;1-17-5-11-25(18(2)35-17)30(37,22-15-34-16-22)21-10-12-26-23(14-21)27(31)24(28(36-26)38-4)13-19-6-8-20(9-7-19)29(3,32)33;1-37-16-34-15-24(37)27(33,19-9-11-23(35-14-19)28(30,31)32)18-8-10-22-20(13-18)25(29)21(26(36-22)38-2)12-17-6-4-3-5-7-17/h4-16,18-20,35H,17H2,1-3H3;5-12,14-15H,13,16,35H2,1-4H3;4-10,16-18,21,39H,11-15H2,1-3H3;5-12,14,22,34,37H,13,15-16H2,1-4H3;3-11,13-16H,12,33H2,1-2H3
• InChIKey: ARKLHXDJVWUNML-UHFFFAOYSA-N
• XLogP: 30.28
• TPSA: 378.90 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 34
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2793.63
LogP ≤ 5	30.28
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine?

The IUPAC name of azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine (CID 157206478) is azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine.

What is the SMILES notation for azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine?

The canonical SMILES for azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine is CC(=O)N1CCC(C(O)(c2ccc3nc(C(C)(F)F)c(Cc4ccccc4)c(Cl)c3c2)c2cncn2C)CC1.CNC(c1ccc(Cl)cc1)(c1ccc2nc(OC)c(Cc3ccc(-n4cccn4)cc3)c(Cl)c2c1)c1cncn1C.COc1nc2ccc(C(CN)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1Cc1ccc(C(F)(F)F)cc1.COc1nc2ccc(C(N)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc2c(Cl)c1Cc1ccccc1.COc1nc2ccc(C(O)(c3ccc(C)nc3C)C3CNC3)cc2c(Cl)c1Cc1ccc(C(C)(F)F)cc1.

What is the InChIKey of azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine?

The InChIKey is ARKLHXDJVWUNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28Cl2N6O.C30H28ClF3N6O.C30H31ClF2N4O2.C30H30ClF2N3O2.C28H23ClF3N5O/c1-35-32(29-19-36-20-39(29)2,22-7-10-24(33)11-8-22)23-9-14-28-26(18-23)30(34)27(31(38-28)41-3)17-21-5-12-25(13-6-21)40-16-4-15-37-40;1-17-5-11-24(18(2)37-17)29(16-35,26-15-36-39-40(26)3)21-10-12-25-22(14-21)27(31)23(28(38-25)41-4)13-19-6-8-20(9-7-19)30(32,33)34;1-19(38)37-13-11-21(12-14-37)30(39,26-17-34-18-36(26)3)22-9-10-25-23(16-22)27(31)24(28(35-25)29(2,32)33)15-20-7-5-4-6-8-20;1-17-5-11-25(18(2)35-17)30(37,22-15-34-16-22)21-10-12-26-23(14-21)27(31)24(28(36-26)38-4)13-19-6-8-20(9-7-19)29(3,32)33;1-37-16-34-15-24(37)27(33,19-9-11-23(35-14-19)28(30,31)32)18-8-10-22-20(13-18)25(29)21(26(36-22)38-2)12-17-6-4-3-5-7-17/h4-16,18-20,35H,17H2,1-3H3;5-12,14-15H,13,16,35H2,1-4H3;4-10,16-18,21,39H,11-15H2,1-3H3;5-12,14,22,34,37H,13,15-16H2,1-4H3;3-11,13-16H,12,33H2,1-2H3.

What are the key properties of azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine?

azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine has a molecular weight of 2793.63 g/mol, XLogP of 30.28, 34 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for azetidin-3-yl-[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)methanol;1-[4-[[3-benzyl-4-chloro-2-(1,1-difluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]piperidin-1-yl]ethanone;(3-benzyl-4-chloro-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanamine;1-[4-chloro-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-1-(4-chlorophenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine;2-[4-chloro-2-methoxy-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-2-(2,6-dimethyl-3-pyridinyl)-2-(3-methyltriazol-4-yl)ethanamine is sourced from PubChem (CID 157206478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).