(4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol

C141H96Cl7F12N19O5 — CID 160667773

About (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol

(4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol (PubChem CID 160667773) has the molecular formula C141H96Cl7F12N19O5 and a molecular weight of 2612.59 g/mol. Its IUPAC name is (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol.

Molecular Properties

• Compound Name: (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol
• PubChem CID: 160667773
• Molecular Formula: C141H96Cl7F12N19O5
• Molecular Weight: 2612.59 g/mol
• Exact Mass: 2607.55
• IUPAC Name: (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol
• SMILES: CCN(CC)c1nc2ccc(C(O)(c3cccnc3)c3cccc(Cl)c3)cc2c(C#N)c1-c1ccccc1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(Cl)c2c1.Cn1cncc1C(O)(c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(Cl)c2c1)c1ccccn1.Cn1cncc1C(O)(c1ccnc(C(F)(F)F)c1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1.N#Cc1nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cccc(Cl)c3)cc2c(C#N)c1-c1ccccc1
• InChI: InChI=1S/C32H27ClN4O.C30H16ClF3N4O.C27H18Cl2F3N3O.C26H17Cl2F3N4O.C26H18ClF3N4O/c1-3-37(4-2)31-30(22-10-6-5-7-11-22)28(20-34)27-19-24(15-16-29(27)36-31)32(38,25-13-9-17-35-21-25)23-12-8-14-26(33)18-23;31-22-8-4-7-19(13-22)29(39,21-10-12-27(37-17-21)30(32,33)34)20-9-11-25-23(14-20)24(15-35)28(26(16-36)38-25)18-5-2-1-3-6-18;1-35-15-33-14-22(35)26(36,17-7-10-19(28)11-8-17)18-9-12-21-20(13-18)24(29)23(16-5-3-2-4-6-16)25(34-21)27(30,31)32;1-35-14-32-13-21(35)25(36,17-9-10-33-20(12-17)26(29,30)31)16-7-8-19-18(11-16)23(27)22(24(28)34-19)15-5-3-2-4-6-15;1-34-15-31-14-21(34)25(35,20-9-5-6-12-32-20)17-10-11-19-18(13-17)23(27)22(16-7-3-2-4-8-16)24(33-19)26(28,29)30/h5-19,21,38H,3-4H2,1-2H3;1-14,17,39H;2-15,36H,1H3;2-14,36H,1H3;2-15,35H,1H3
• InChIKey: RMNOKYHKRCYVHJ-UHFFFAOYSA-N
• XLogP: 33.82
• TPSA: 345.23 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 24
• Rotatable Bonds: 23
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2612.59
LogP ≤ 5	33.82
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol?

The IUPAC name of (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol (CID 160667773) is (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol.

What is the SMILES notation for (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol?

The canonical SMILES for (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol is CCN(CC)c1nc2ccc(C(O)(c3cccnc3)c3cccc(Cl)c3)cc2c(C#N)c1-c1ccccc1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(Cl)c2c1.Cn1cncc1C(O)(c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(Cl)c2c1)c1ccccn1.Cn1cncc1C(O)(c1ccnc(C(F)(F)F)c1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1.N#Cc1nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cccc(Cl)c3)cc2c(C#N)c1-c1ccccc1.

What is the InChIKey of (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol?

The InChIKey is RMNOKYHKRCYVHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H27ClN4O.C30H16ClF3N4O.C27H18Cl2F3N3O.C26H17Cl2F3N4O.C26H18ClF3N4O/c1-3-37(4-2)31-30(22-10-6-5-7-11-22)28(20-34)27-19-24(15-16-29(27)36-31)32(38,25-13-9-17-35-21-25)23-12-8-14-26(33)18-23;31-22-8-4-7-19(13-22)29(39,21-10-12-27(37-17-21)30(32,33)34)20-9-11-25-23(14-20)24(15-35)28(26(16-36)38-25)18-5-2-1-3-6-18;1-35-15-33-14-22(35)26(36,17-7-10-19(28)11-8-17)18-9-12-21-20(13-18)24(29)23(16-5-3-2-4-6-16)25(34-21)27(30,31)32;1-35-14-32-13-21(35)25(36,17-9-10-33-20(12-17)26(29,30)31)16-7-8-19-18(11-16)23(27)22(24(28)34-19)15-5-3-2-4-6-15;1-34-15-31-14-21(34)25(35,20-9-5-6-12-32-20)17-10-11-19-18(13-17)23(27)22(16-7-3-2-4-8-16)24(33-19)26(28,29)30/h5-19,21,38H,3-4H2,1-2H3;1-14,17,39H;2-15,36H,1H3;2-14,36H,1H3;2-15,35H,1H3.

What are the key properties of (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol?

(4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol has a molecular weight of 2612.59 g/mol, XLogP of 33.82, 23 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for (4-chlorophenyl)-[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;6-[(3-chlorophenyl)-hydroxy-pyridin-3-ylmethyl]-2-(diethylamino)-3-phenylquinoline-4-carbonitrile;6-[(3-chlorophenyl)-hydroxy-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenylquinoline-2,4-dicarbonitrile;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol is sourced from PubChem (CID 160667773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).