[4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone

C143H132Cl13F10N22O14+ — CID 158491403

About [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone

[4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone (PubChem CID 158491403) has the molecular formula C143H132Cl13F10N22O14+ and a molecular weight of 3033.64 g/mol. Its IUPAC name is [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone.

Molecular Properties

• Compound Name: [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone
• PubChem CID: 158491403
• Molecular Formula: C143H132Cl13F10N22O14+
• Molecular Weight: 3033.64 g/mol
• Exact Mass: 3025.61
• IUPAC Name: [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone
• SMILES: CC(=O)N1CCC(C(O)(c2ccccc2)c2ccc3nc(Cl)c(OC(C)C)c(Cl)c3c2)CC1.CCOc1c(Cl)nc2ccc(C(O)(C3=[N+](C)C=NC3)c3ccc(C(F)(F)F)nc3)cc2c1Cl.CCOc1c(Cl)nc2ccc(C(O)(c3ccc(Cl)cc3)c3cncn3C)cc2c1Cl.COc1nc2ccc(C(O)(c3cnc(C)n3C)c3cnc(C)n3C)cc2c(Cl)c1OC1CCCN(C)C1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(Cl)c(OCC(C)(F)F)c(Cl)c2c1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(Cl)c(OCC(C)(F)F)c(Cl)c2c1
• InChI: InChI=1S/C27H33ClN6O3.C26H28Cl2N2O3.C23H18Cl3F2N3O2.C23H17Cl2F5N4O2.C22H18Cl3N3O2.C22H18Cl2F3N4O2/c1-16-29-13-22(33(16)4)27(35,23-14-30-17(2)34(23)5)18-9-10-21-20(12-18)24(28)25(26(31-21)36-6)37-19-8-7-11-32(3)15-19;1-16(2)33-24-23(27)21-15-20(9-10-22(21)29-25(24)28)26(32,18-7-5-4-6-8-18)19-11-13-30(14-12-19)17(3)31;1-22(27,28)11-33-20-19(25)16-9-14(5-8-17(16)30-21(20)26)23(32,18-10-29-12-31(18)2)13-3-6-15(24)7-4-13;1-21(26,27)10-36-19-18(24)14-7-12(3-5-15(14)33-20(19)25)22(35,17-9-31-11-34(17)2)13-4-6-16(32-8-13)23(28,29)30;1-3-30-20-19(24)16-10-14(6-9-17(16)27-21(20)25)22(29,18-11-26-12-28(18)2)13-4-7-15(23)8-5-13;1-3-33-19-18(23)14-8-12(4-6-15(14)30-20(19)24)21(32,17-10-28-11-31(17)2)13-5-7-16(29-9-13)22(25,26)27/h9-10,12-14,19,35H,7-8,11,15H2,1-6H3;4-10,15-16,19,32H,11-14H2,1-3H3;3-10,12,32H,11H2,1-2H3;3-9,11,35H,10H2,1-2H3;4-12,29H,3H2,1-2H3;4-9,11,32H,3,10H2,1-2H3/q;;;;;+1
• InChIKey: ALGULVMDSVWHNV-UHFFFAOYSA-N
• XLogP: 32.14
• TPSA: 417.13 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 34
• Rotatable Bonds: 33
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3033.64
LogP ≤ 5	32.14
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone?

The IUPAC name of [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone (CID 158491403) is [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone.

What is the SMILES notation for [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone?

The canonical SMILES for [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone is CC(=O)N1CCC(C(O)(c2ccccc2)c2ccc3nc(Cl)c(OC(C)C)c(Cl)c3c2)CC1.CCOc1c(Cl)nc2ccc(C(O)(C3=[N+](C)C=NC3)c3ccc(C(F)(F)F)nc3)cc2c1Cl.CCOc1c(Cl)nc2ccc(C(O)(c3ccc(Cl)cc3)c3cncn3C)cc2c1Cl.COc1nc2ccc(C(O)(c3cnc(C)n3C)c3cnc(C)n3C)cc2c(Cl)c1OC1CCCN(C)C1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(Cl)c(OCC(C)(F)F)c(Cl)c2c1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(Cl)c(OCC(C)(F)F)c(Cl)c2c1.

What is the InChIKey of [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone?

The InChIKey is ALGULVMDSVWHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33ClN6O3.C26H28Cl2N2O3.C23H18Cl3F2N3O2.C23H17Cl2F5N4O2.C22H18Cl3N3O2.C22H18Cl2F3N4O2/c1-16-29-13-22(33(16)4)27(35,23-14-30-17(2)34(23)5)18-9-10-21-20(12-18)24(28)25(26(31-21)36-6)37-19-8-7-11-32(3)15-19;1-16(2)33-24-23(27)21-15-20(9-10-22(21)29-25(24)28)26(32,18-7-5-4-6-8-18)19-11-13-30(14-12-19)17(3)31;1-22(27,28)11-33-20-19(25)16-9-14(5-8-17(16)30-21(20)26)23(32,18-10-29-12-31(18)2)13-3-6-15(24)7-4-13;1-21(26,27)10-36-19-18(24)14-7-12(3-5-15(14)33-20(19)25)22(35,17-9-31-11-34(17)2)13-4-6-16(32-8-13)23(28,29)30;1-3-30-20-19(24)16-10-14(6-9-17(16)27-21(20)25)22(29,18-11-26-12-28(18)2)13-4-7-15(23)8-5-13;1-3-33-19-18(23)14-8-12(4-6-15(14)30-20(19)24)21(32,17-10-28-11-31(17)2)13-5-7-16(29-9-13)22(25,26)27/h9-10,12-14,19,35H,7-8,11,15H2,1-6H3;4-10,15-16,19,32H,11-14H2,1-3H3;3-10,12,32H,11H2,1-2H3;3-9,11,35H,10H2,1-2H3;4-12,29H,3H2,1-2H3;4-9,11,32H,3,10H2,1-2H3/q;;;;;+1.

What are the key properties of [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone?

[4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone has a molecular weight of 3033.64 g/mol, XLogP of 32.14, 33 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for [4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(1-methyl-4H-imidazol-1-ium-5-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone is sourced from PubChem (CID 158491403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).