(4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol

C195H138Cl11F22N19O8S — CID 158977880

About (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol

(4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol (PubChem CID 158977880) has the molecular formula C195H138Cl11F22N19O8S and a molecular weight of 3715.38 g/mol. Its IUPAC name is (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol.

Molecular Properties

• Compound Name: (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol
• PubChem CID: 158977880
• Molecular Formula: C195H138Cl11F22N19O8S
• Molecular Weight: 3715.38 g/mol
• Exact Mass: 3707.69
• IUPAC Name: (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol
• SMILES: Cc1cc(C(O)(c2cc(C)c3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2cncn2C)ccn1.Cc1cc(C(O)(c2ccnc(C(F)(F)F)c2)c2cncn2C)cc2c(Cl)c(-c3ccccc3)c(Cl)nc12.Cc1ccc(C(O)(c2cc(C)c3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2sccc2C)cn1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1cc2c(Cl)c(-c3ccccc3)c(Cl)nc2cc1F.OC(c1ccccc1)(c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C(F)(F)F)c2c1)C1CCNCC1.OC(c1cccnc1)(c1cccc(Cl)c1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C(F)(F)F)c2c1.[O-][n+]1cccc(C(O)(c2cccc(Cl)c2)c2ccc3nc(C(F)(F)F)c(-c4ccccc4)c(C(F)(F)F)c3c2)c1
• InChI: InChI=1S/C29H17ClF6N2O2.C29H17ClF6N2O.C29H24F6N2O.C28H22Cl2N2OS.C27H19Cl2F3N4O.C27H22Cl2N4O.C26H17Cl3FN3O/c30-21-10-4-8-18(14-21)27(39,20-9-5-13-38(40)16-20)19-11-12-23-22(15-19)25(28(31,32)33)24(17-6-2-1-3-7-17)26(37-23)29(34,35)36;30-21-10-4-8-18(14-21)27(39,20-9-5-13-37-16-20)19-11-12-23-22(15-19)25(28(31,32)33)24(17-6-2-1-3-7-17)26(38-23)29(34,35)36;30-28(31,32)25-22-17-21(27(38,19-9-5-2-6-10-19)20-13-15-36-16-14-20)11-12-23(22)37-26(29(33,34)35)24(25)18-7-3-1-4-8-18;1-16-11-12-34-26(16)28(33,20-10-9-18(3)31-15-20)21-13-17(2)25-22(14-21)24(29)23(27(30)32-25)19-7-5-4-6-8-19;1-15-10-18(11-19-23(28)22(25(29)35-24(15)19)16-6-4-3-5-7-16)26(37,21-13-33-14-36(21)2)17-8-9-34-20(12-17)27(30,31)32;1-16-11-20(27(34,22-14-30-15-33(22)3)19-9-10-31-17(2)12-19)13-21-24(28)23(26(29)32-25(16)21)18-7-5-4-6-8-18;1-33-14-31-13-22(33)26(34,16-7-9-17(27)10-8-16)19-11-18-21(12-20(19)30)32-25(29)23(24(18)28)15-5-3-2-4-6-15/h1-16,39H;1-16,39H;1-12,17,20,36,38H,13-16H2;4-15,33H,1-3H3;3-14,37H,1-2H3;4-15,34H,1-3H3;2-14,34H,1H3
• InChIKey: JOPSYJMJGUGMPF-UHFFFAOYSA-N
• XLogP: 51.04
• TPSA: 375.83 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 27
• Rotatable Bonds: 28
• Heavy Atoms: 256
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3715.38
LogP ≤ 5	51.04
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol?

The IUPAC name of (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol (CID 158977880) is (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol.

What is the SMILES notation for (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol?

The canonical SMILES for (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol is Cc1cc(C(O)(c2cc(C)c3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2cncn2C)ccn1.Cc1cc(C(O)(c2ccnc(C(F)(F)F)c2)c2cncn2C)cc2c(Cl)c(-c3ccccc3)c(Cl)nc12.Cc1ccc(C(O)(c2cc(C)c3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2sccc2C)cn1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1cc2c(Cl)c(-c3ccccc3)c(Cl)nc2cc1F.OC(c1ccccc1)(c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C(F)(F)F)c2c1)C1CCNCC1.OC(c1cccnc1)(c1cccc(Cl)c1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C(F)(F)F)c2c1.[O-][n+]1cccc(C(O)(c2cccc(Cl)c2)c2ccc3nc(C(F)(F)F)c(-c4ccccc4)c(C(F)(F)F)c3c2)c1.

What is the InChIKey of (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol?

The InChIKey is JOPSYJMJGUGMPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H17ClF6N2O2.C29H17ClF6N2O.C29H24F6N2O.C28H22Cl2N2OS.C27H19Cl2F3N4O.C27H22Cl2N4O.C26H17Cl3FN3O/c30-21-10-4-8-18(14-21)27(39,20-9-5-13-38(40)16-20)19-11-12-23-22(15-19)25(28(31,32)33)24(17-6-2-1-3-7-17)26(37-23)29(34,35)36;30-21-10-4-8-18(14-21)27(39,20-9-5-13-37-16-20)19-11-12-23-22(15-19)25(28(31,32)33)24(17-6-2-1-3-7-17)26(38-23)29(34,35)36;30-28(31,32)25-22-17-21(27(38,19-9-5-2-6-10-19)20-13-15-36-16-14-20)11-12-23(22)37-26(29(33,34)35)24(25)18-7-3-1-4-8-18;1-16-11-12-34-26(16)28(33,20-10-9-18(3)31-15-20)21-13-17(2)25-22(14-21)24(29)23(27(30)32-25)19-7-5-4-6-8-19;1-15-10-18(11-19-23(28)22(25(29)35-24(15)19)16-6-4-3-5-7-16)26(37,21-13-33-14-36(21)2)17-8-9-34-20(12-17)27(30,31)32;1-16-11-20(27(34,22-14-30-15-33(22)3)19-9-10-31-17(2)12-19)13-21-24(28)23(26(29)32-25(16)21)18-7-5-4-6-8-18;1-33-14-31-13-22(33)26(34,16-7-9-17(27)10-8-16)19-11-18-21(12-20(19)30)32-25(29)23(24(18)28)15-5-3-2-4-6-15/h1-16,39H;1-16,39H;1-12,17,20,36,38H,13-16H2;4-15,33H,1-3H3;3-14,37H,1-2H3;4-15,34H,1-3H3;2-14,34H,1H3.

What are the key properties of (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol?

(4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol has a molecular weight of 3715.38 g/mol, XLogP of 51.04, 28 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for (4-chlorophenyl)-(2,4-dichloro-7-fluoro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;(3-chlorophenyl)-(1-oxidopyridin-1-ium-3-yl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]methanol;(3-chlorophenyl)-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-pyridin-3-ylmethanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-8-methyl-3-phenylquinolin-6-yl)-(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanol;phenyl-[3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl]-piperidin-4-ylmethanol is sourced from PubChem (CID 158977880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).