4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol

C208H154Cl15N33O13 — CID 162187601

IUPAC4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol
SMILESCOC(c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1)(c1cnccn1)c1nccn1C.COC(c1ccncc1)(c1ccc2nc(N(C)C)c(-c3ccccc3)c(Cl)c2c1)c1nccn1C.COc1ccc(C(O)(c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2c(C)noc2C)cn1.COc1ccc(C(O)(c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2cc(C)no2)cn1.Cc1cc(C(O)(c2ccc(Cl)cc2)c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)on1.Cn1ccnc1C(O)(c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1)c1cnccn1.Cn1ccnc1C(O)(c1ccnnc1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(C#N)c(-c3ccccc3)c(C#N)c2c1
InChIInChI=1S/C28H26ClN5O.C28H18ClN5O.C27H21Cl2N3O3.C26H17Cl3N2O2.C26H19Cl2N3O3.C25H19Cl2N5O.2C24H17Cl2N5O/c1-33(2)26-24(19-8-6-5-7-9-19)25(29)22-18-21(10-11-23(22)32-26)28(35-4,20-12-14-30-15-13-20)27-31-16-17-34(27)3;1-34-17-32-16-26(34)28(35,19-7-10-21(29)11-8-19)20-9-12-24-22(13-20)23(14-30)27(25(15-31)33-24)18-5-3-2-4-6-18;1-15-24(16(2)35-32-15)27(33,19-10-12-22(34-3)30-14-19)18-9-11-21-20(13-18)25(28)23(26(29)31-21)17-7-5-4-6-8-17;1-15-13-22(33-31-15)26(32,17-7-10-19(27)11-8-17)18-9-12-21-20(14-18)24(28)23(25(29)30-21)16-5-3-2-4-6-16;1-15-12-21(34-31-15)26(32,18-9-11-22(33-2)29-14-18)17-8-10-20-19(13-17)24(27)23(25(28)30-20)16-6-4-3-5-7-16;1-32-13-12-30-24(32)25(33-2,20-15-28-10-11-29-20)17-8-9-19-18(14-17)22(26)21(23(27)31-19)16-6-4-3-5-7-16;1-31-12-11-29-23(31)24(32,19-14-27-9-10-28-19)16-7-8-18-17(13-16)21(25)20(22(26)30-18)15-5-3-2-4-6-15;1-31-12-11-27-23(31)24(32,17-9-10-28-29-14-17)16-7-8-19-18(13-16)21(25)20(22(26)30-19)15-5-3-2-4-6-15/h5-18H,1-4H3;2-13,16-17,35H,1H3;4-14,33H,1-3H3;2-14,32H,1H3;3-14,32H,1-2H3;3-15H,1-2H3;2*2-14,32H,1H3
InChIKeyZPWBTWGEVQXJKD-UHFFFAOYSA-N
MW3855.53 g/mol
LogP46.84
Rot. Bonds37

About 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol

4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol (PubChem CID 162187601) has the molecular formula C208H154Cl15N33O13 and a molecular weight of 3855.53 g/mol. Its IUPAC name is 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol.

Molecular Properties

Compound Name4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol
PubChem CID162187601
Molecular FormulaC208H154Cl15N33O13
Molecular Weight3855.53 g/mol
Exact Mass3845.77
IUPAC Name4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol
SMILESCOC(c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1)(c1cnccn1)c1nccn1C.COC(c1ccncc1)(c1ccc2nc(N(C)C)c(-c3ccccc3)c(Cl)c2c1)c1nccn1C.COc1ccc(C(O)(c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2c(C)noc2C)cn1.COc1ccc(C(O)(c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2cc(C)no2)cn1.Cc1cc(C(O)(c2ccc(Cl)cc2)c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)on1.Cn1ccnc1C(O)(c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1)c1cnccn1.Cn1ccnc1C(O)(c1ccnnc1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(C#N)c(-c3ccccc3)c(C#N)c2c1
InChIInChI=1S/C28H26ClN5O.C28H18ClN5O.C27H21Cl2N3O3.C26H17Cl3N2O2.C26H19Cl2N3O3.C25H19Cl2N5O.2C24H17Cl2N5O/c1-33(2)26-24(19-8-6-5-7-9-19)25(29)22-18-21(10-11-23(22)32-26)28(35-4,20-12-14-30-15-13-20)27-31-16-17-34(27)3;1-34-17-32-16-26(34)28(35,19-7-10-21(29)11-8-19)20-9-12-24-22(13-20)23(14-30)27(25(15-31)33-24)18-5-3-2-4-6-18;1-15-24(16(2)35-32-15)27(33,19-10-12-22(34-3)30-14-19)18-9-11-21-20(13-18)25(28)23(26(29)31-21)17-7-5-4-6-8-17;1-15-13-22(33-31-15)26(32,17-7-10-19(27)11-8-17)18-9-12-21-20(14-18)24(28)23(25(29)30-21)16-5-3-2-4-6-16;1-15-12-21(34-31-15)26(32,18-9-11-22(33-2)29-14-18)17-8-10-20-19(13-17)24(27)23(25(28)30-20)16-6-4-3-5-7-16;1-32-13-12-30-24(32)25(33-2,20-15-28-10-11-29-20)17-8-9-19-18(14-17)22(26)21(23(27)31-19)16-6-4-3-5-7-16;1-31-12-11-29-23(31)24(32,19-14-27-9-10-28-19)16-7-8-18-17(13-16)21(25)20(22(26)30-18)15-5-3-2-4-6-15;1-31-12-11-27-23(31)24(32,17-9-10-28-29-14-17)16-7-8-19-18(13-16)21(25)20(22(26)30-19)15-5-3-2-4-6-15/h5-18H,1-4H3;2-13,16-17,35H,1H3;4-14,33H,1-3H3;2-14,32H,1H3;3-14,32H,1-2H3;3-15H,1-2H3;2*2-14,32H,1H3
InChIKeyZPWBTWGEVQXJKD-UHFFFAOYSA-N
XLogP46.84
TPSA595.44 Ų
H-Bond Donors6
H-Bond Acceptors46
Rotatable Bonds37
Heavy Atoms269
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003855.53
LogP ≤ 546.84
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

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

Analyze 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol?
The IUPAC name of 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol (CID 162187601) is 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol.
What is the SMILES notation for 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol?
The canonical SMILES for 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol is COC(c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1)(c1cnccn1)c1nccn1C.COC(c1ccncc1)(c1ccc2nc(N(C)C)c(-c3ccccc3)c(Cl)c2c1)c1nccn1C.COc1ccc(C(O)(c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2c(C)noc2C)cn1.COc1ccc(C(O)(c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)c2cc(C)no2)cn1.Cc1cc(C(O)(c2ccc(Cl)cc2)c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)on1.Cn1ccnc1C(O)(c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1)c1cnccn1.Cn1ccnc1C(O)(c1ccnnc1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2nc(C#N)c(-c3ccccc3)c(C#N)c2c1.
What is the InChIKey of 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol?
The InChIKey is ZPWBTWGEVQXJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26ClN5O.C28H18ClN5O.C27H21Cl2N3O3.C26H17Cl3N2O2.C26H19Cl2N3O3.C25H19Cl2N5O.2C24H17Cl2N5O/c1-33(2)26-24(19-8-6-5-7-9-19)25(29)22-18-21(10-11-23(22)32-26)28(35-4,20-12-14-30-15-13-20)27-31-16-17-34(27)3;1-34-17-32-16-26(34)28(35,19-7-10-21(29)11-8-19)20-9-12-24-22(13-20)23(14-30)27(25(15-31)33-24)18-5-3-2-4-6-18;1-15-24(16(2)35-32-15)27(33,19-10-12-22(34-3)30-14-19)18-9-11-21-20(13-18)25(28)23(26(29)31-21)17-7-5-4-6-8-17;1-15-13-22(33-31-15)26(32,17-7-10-19(27)11-8-17)18-9-12-21-20(14-18)24(28)23(25(29)30-21)16-5-3-2-4-6-16;1-15-12-21(34-31-15)26(32,18-9-11-22(33-2)29-14-18)17-8-10-20-19(13-17)24(27)23(25(28)30-20)16-6-4-3-5-7-16;1-32-13-12-30-24(32)25(33-2,20-15-28-10-11-29-20)17-8-9-19-18(14-17)22(26)21(23(27)31-19)16-6-4-3-5-7-16;1-31-12-11-29-23(31)24(32,19-14-27-9-10-28-19)16-7-8-18-17(13-16)21(25)20(22(26)30-18)15-5-3-2-4-6-15;1-31-12-11-27-23(31)24(32,17-9-10-28-29-14-17)16-7-8-19-18(13-16)21(25)20(22(26)30-19)15-5-3-2-4-6-15/h5-18H,1-4H3;2-13,16-17,35H,1H3;4-14,33H,1-3H3;2-14,32H,1H3;3-14,32H,1-2H3;3-15H,1-2H3;2*2-14,32H,1H3.
What are the key properties of 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol?
4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol has a molecular weight of 3855.53 g/mol, XLogP of 46.84, 37 rotatable bonds, 6 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-[methoxy-(1-methylimidazol-2-yl)-pyridin-4-ylmethyl]-N,N-dimethyl-3-phenylquinolin-2-amine;(4-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methyl-1,2-oxazol-5-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3-phenylquinoline-2,4-dicarbonitrile;2,4-dichloro-6-[methoxy-(1-methylimidazol-2-yl)-pyrazin-2-ylmethyl]-3-phenylquinoline;(2,4-dichloro-3-phenylquinolin-6-yl)-(3,5-dimethyl-1,2-oxazol-4-yl)-(6-methoxy-3-pyridinyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(6-methoxy-3-pyridinyl)-(3-methyl-1,2-oxazol-5-yl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyrazin-2-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylimidazol-2-yl)-pyridazin-4-ylmethanol is sourced from PubChem (CID 162187601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).