4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol

C138H112Cl10N18O4 — CID 157380836

About 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol

4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol (PubChem CID 157380836) has the molecular formula C138H112Cl10N18O4 and a molecular weight of 2441.07 g/mol. Its IUPAC name is 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol.

Molecular Properties

• Compound Name: 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol
• PubChem CID: 157380836
• Molecular Formula: C138H112Cl10N18O4
• Molecular Weight: 2441.07 g/mol
• Exact Mass: 2434.60
• IUPAC Name: 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol
• SMILES: CCCN(C)c1nc2ccc(C(O)(c3ccncc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CN(C)c1nc2ccc(C(O)(c3ccc(Cl)cc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CN(C)c1nc2ccc(C(c3ccc(Cl)cc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(Cl)c(-c3ccccc3)cc2c1.OC(c1ccccc1)(c1ccncc1)c1ccc2nc(Cl)c(-c3ccccc3Cl)c(Cl)c2c1
• InChI: InChI=1S/C29H28ClN5O.C28H24Cl2N4O.C28H24Cl2N4.C27H17Cl3N2O.C26H19Cl2N3O/c1-4-16-34(2)28-26(20-8-6-5-7-9-20)27(30)23-17-22(10-11-24(23)33-28)29(36,21-12-14-31-15-13-21)25-18-32-19-35(25)3;1-33(2)27-25(18-7-5-4-6-8-18)26(30)22-15-20(11-14-23(22)32-27)28(35,24-16-31-17-34(24)3)19-9-12-21(29)13-10-19;1-33(2)28-26(18-7-5-4-6-8-18)27(30)22-15-20(11-14-23(22)32-28)25(24-16-31-17-34(24)3)19-9-12-21(29)13-10-19;28-22-9-5-4-8-20(22)24-25(29)21-16-19(10-11-23(21)32-26(24)30)27(33,17-6-2-1-3-7-17)18-12-14-31-15-13-18;1-31-16-29-15-24(31)26(32,19-7-10-21(27)11-8-19)20-9-12-23-18(13-20)14-22(25(28)30-23)17-5-3-2-4-6-17/h5-15,17-19,36H,4,16H2,1-3H3;4-17,35H,1-3H3;4-17,25H,1-3H3;1-16,33H;2-16,32H,1H3
• InChIKey: BKWBNCLHGAAHGP-UHFFFAOYSA-N
• XLogP: 33.06
• TPSA: 252.15 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 25
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2441.07
LogP ≤ 5	33.06
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol?

The IUPAC name of 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol (CID 157380836) is 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol.

What is the SMILES notation for 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol?

The canonical SMILES for 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol is CCCN(C)c1nc2ccc(C(O)(c3ccncc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CN(C)c1nc2ccc(C(O)(c3ccc(Cl)cc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CN(C)c1nc2ccc(C(c3ccc(Cl)cc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(Cl)c(-c3ccccc3)cc2c1.OC(c1ccccc1)(c1ccncc1)c1ccc2nc(Cl)c(-c3ccccc3Cl)c(Cl)c2c1.

What is the InChIKey of 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol?

The InChIKey is BKWBNCLHGAAHGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28ClN5O.C28H24Cl2N4O.C28H24Cl2N4.C27H17Cl3N2O.C26H19Cl2N3O/c1-4-16-34(2)28-26(20-8-6-5-7-9-20)27(30)23-17-22(10-11-24(23)33-28)29(36,21-12-14-31-15-13-21)25-18-32-19-35(25)3;1-33(2)27-25(18-7-5-4-6-8-18)26(30)22-15-20(11-14-23(22)32-27)28(35,24-16-31-17-34(24)3)19-9-12-21(29)13-10-19;1-33(2)28-26(18-7-5-4-6-8-18)27(30)22-15-20(11-14-23(22)32-28)25(24-16-31-17-34(24)3)19-9-12-21(29)13-10-19;28-22-9-5-4-8-20(22)24-25(29)21-16-19(10-11-23(21)32-26(24)30)27(33,17-6-2-1-3-7-17)18-12-14-31-15-13-18;1-31-16-29-15-24(31)26(32,19-7-10-21(27)11-8-19)20-9-12-23-18(13-20)14-22(25(28)30-23)17-5-3-2-4-6-17/h5-15,17-19,36H,4,16H2,1-3H3;4-17,35H,1-3H3;4-17,25H,1-3H3;1-16,33H;2-16,32H,1H3.

What are the key properties of 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol?

4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol has a molecular weight of 2441.07 g/mol, XLogP of 33.06, 25 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-N,N-dimethyl-3-phenylquinolin-2-amine;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(4-chlorophenyl)-(2-chloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2-chlorophenyl)quinolin-6-yl]-phenyl-pyridin-4-ylmethanol is sourced from PubChem (CID 157380836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).