4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine

C143H121Cl11F7N23O4 — CID 159229384

IUPAC4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine
SMILESCN1CCN(c2ccc(-c3nc4ccncc4[nH]3)cc2)CC1.CN1CCN(c2ccc(-c3nc4nc(Cl)c(Cl)cc4[nH]3)cc2)CC1.CN1CCN(c2ccc(C3=Nc4ccc(F)cc4C3)cc2)CC1.Cc1ccc2c(c1)CC(c1ccc(N3CCN(C)CC3)cc1)=N2.Cc1ccc2c(c1)N=C(c1cccc(Cl)c1O)C2.FC(F)(F)c1ccc(C2=Nc3c(Cl)cc(Cl)cc3C2)cc1.Oc1ccc(Cl)cc1-c1nc2nc(Cl)c(Cl)cc2[nH]1.Oc1ccc(F)cc1C1=Nc2c(Cl)cc(Cl)cc2C1.Oc1ccc(F)cc1C1=Nc2cc(Cl)c(F)cc2C1
InChIInChI=1S/C20H23N3.C19H20FN3.C17H17Cl2N5.C17H19N5.C15H8Cl2F3N.C15H12ClNO.C14H8Cl2FNO.C14H8ClF2NO.C12H6Cl3N3O/c1-15-3-8-19-17(13-15)14-20(21-19)16-4-6-18(7-5-16)23-11-9-22(2)10-12-23;1-22-8-10-23(11-9-22)17-5-2-14(3-6-17)19-13-15-12-16(20)4-7-18(15)21-19;1-23-6-8-24(9-7-23)12-4-2-11(3-5-12)16-20-14-10-13(18)15(19)21-17(14)22-16;1-21-8-10-22(11-9-21)14-4-2-13(3-5-14)17-19-15-6-7-18-12-16(15)20-17;16-11-5-9-6-13(21-14(9)12(17)7-11)8-1-3-10(4-2-8)15(18,19)20;1-9-5-6-10-8-14(17-13(10)7-9)11-3-2-4-12(16)15(11)18;15-8-3-7-4-12(18-14(7)11(16)5-8)10-6-9(17)1-2-13(10)19;15-10-6-12-7(3-11(10)17)4-13(18-12)9-5-8(16)1-2-14(9)19;13-5-1-2-9(19)6(3-5)11-16-8-4-7(14)10(15)17-12(8)18-11/h3-8,13H,9-12,14H2,1-2H3;2-7,12H,8-11,13H2,1H3;2-5,10H,6-9H2,1H3,(H,20,21,22);2-7,12H,8-11H2,1H3,(H,19,20);1-5,7H,6H2;2-7,18H,8H2,1H3;2*1-3,5-6,19H,4H2;1-4,19H,(H,16,17,18)
InChIKeyKSRVKQPVIMUDCF-UHFFFAOYSA-N
MW2748.67 g/mol
LogP35.26
Rot. Bonds13

About 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine

4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine (PubChem CID 159229384) has the molecular formula C143H121Cl11F7N23O4 and a molecular weight of 2748.67 g/mol. Its IUPAC name is 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine
PubChem CID159229384
Molecular FormulaC143H121Cl11F7N23O4
Molecular Weight2748.67 g/mol
Exact Mass2741.64
IUPAC Name4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine
SMILESCN1CCN(c2ccc(-c3nc4ccncc4[nH]3)cc2)CC1.CN1CCN(c2ccc(-c3nc4nc(Cl)c(Cl)cc4[nH]3)cc2)CC1.CN1CCN(c2ccc(C3=Nc4ccc(F)cc4C3)cc2)CC1.Cc1ccc2c(c1)CC(c1ccc(N3CCN(C)CC3)cc1)=N2.Cc1ccc2c(c1)N=C(c1cccc(Cl)c1O)C2.FC(F)(F)c1ccc(C2=Nc3c(Cl)cc(Cl)cc3C2)cc1.Oc1ccc(Cl)cc1-c1nc2nc(Cl)c(Cl)cc2[nH]1.Oc1ccc(F)cc1C1=Nc2c(Cl)cc(Cl)cc2C1.Oc1ccc(F)cc1C1=Nc2cc(Cl)c(F)cc2C1
InChIInChI=1S/C20H23N3.C19H20FN3.C17H17Cl2N5.C17H19N5.C15H8Cl2F3N.C15H12ClNO.C14H8Cl2FNO.C14H8ClF2NO.C12H6Cl3N3O/c1-15-3-8-19-17(13-15)14-20(21-19)16-4-6-18(7-5-16)23-11-9-22(2)10-12-23;1-22-8-10-23(11-9-22)17-5-2-14(3-6-17)19-13-15-12-16(20)4-7-18(15)21-19;1-23-6-8-24(9-7-23)12-4-2-11(3-5-12)16-20-14-10-13(18)15(19)21-17(14)22-16;1-21-8-10-22(11-9-21)14-4-2-13(3-5-14)17-19-15-6-7-18-12-16(15)20-17;16-11-5-9-6-13(21-14(9)12(17)7-11)8-1-3-10(4-2-8)15(18,19)20;1-9-5-6-10-8-14(17-13(10)7-9)11-3-2-4-12(16)15(11)18;15-8-3-7-4-12(18-14(7)11(16)5-8)10-6-9(17)1-2-13(10)19;15-10-6-12-7(3-11(10)17)4-13(18-12)9-5-8(16)1-2-14(9)19;13-5-1-2-9(19)6(3-5)11-16-8-4-7(14)10(15)17-12(8)18-11/h3-8,13H,9-12,14H2,1-2H3;2-7,12H,8-11,13H2,1H3;2-5,10H,6-9H2,1H3,(H,20,21,22);2-7,12H,8-11H2,1H3,(H,19,20);1-5,7H,6H2;2-7,18H,8H2,1H3;2*1-3,5-6,19H,4H2;1-4,19H,(H,16,17,18)
InChIKeyKSRVKQPVIMUDCF-UHFFFAOYSA-N
XLogP35.26
TPSA305.71 Ų
H-Bond Donors7
H-Bond Acceptors24
Rotatable Bonds13
Heavy Atoms188
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002748.67
LogP ≤ 535.26
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_G(9)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine (CID 159229384) is 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine is CN1CCN(c2ccc(-c3nc4ccncc4[nH]3)cc2)CC1.CN1CCN(c2ccc(-c3nc4nc(Cl)c(Cl)cc4[nH]3)cc2)CC1.CN1CCN(c2ccc(C3=Nc4ccc(F)cc4C3)cc2)CC1.Cc1ccc2c(c1)CC(c1ccc(N3CCN(C)CC3)cc1)=N2.Cc1ccc2c(c1)N=C(c1cccc(Cl)c1O)C2.FC(F)(F)c1ccc(C2=Nc3c(Cl)cc(Cl)cc3C2)cc1.Oc1ccc(Cl)cc1-c1nc2nc(Cl)c(Cl)cc2[nH]1.Oc1ccc(F)cc1C1=Nc2c(Cl)cc(Cl)cc2C1.Oc1ccc(F)cc1C1=Nc2cc(Cl)c(F)cc2C1.
What is the InChIKey of 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?
The InChIKey is KSRVKQPVIMUDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3.C19H20FN3.C17H17Cl2N5.C17H19N5.C15H8Cl2F3N.C15H12ClNO.C14H8Cl2FNO.C14H8ClF2NO.C12H6Cl3N3O/c1-15-3-8-19-17(13-15)14-20(21-19)16-4-6-18(7-5-16)23-11-9-22(2)10-12-23;1-22-8-10-23(11-9-22)17-5-2-14(3-6-17)19-13-15-12-16(20)4-7-18(15)21-19;1-23-6-8-24(9-7-23)12-4-2-11(3-5-12)16-20-14-10-13(18)15(19)21-17(14)22-16;1-21-8-10-22(11-9-21)14-4-2-13(3-5-14)17-19-15-6-7-18-12-16(15)20-17;16-11-5-9-6-13(21-14(9)12(17)7-11)8-1-3-10(4-2-8)15(18,19)20;1-9-5-6-10-8-14(17-13(10)7-9)11-3-2-4-12(16)15(11)18;15-8-3-7-4-12(18-14(7)11(16)5-8)10-6-9(17)1-2-13(10)19;15-10-6-12-7(3-11(10)17)4-13(18-12)9-5-8(16)1-2-14(9)19;13-5-1-2-9(19)6(3-5)11-16-8-4-7(14)10(15)17-12(8)18-11/h3-8,13H,9-12,14H2,1-2H3;2-7,12H,8-11,13H2,1H3;2-5,10H,6-9H2,1H3,(H,20,21,22);2-7,12H,8-11H2,1H3,(H,19,20);1-5,7H,6H2;2-7,18H,8H2,1H3;2*1-3,5-6,19H,4H2;1-4,19H,(H,16,17,18).
What are the key properties of 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?
4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine has a molecular weight of 2748.67 g/mol, XLogP of 35.26, 13 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(5,6-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol;2-(6-chloro-5-fluoro-3H-indol-2-yl)-4-fluorophenol;2-chloro-6-(6-methyl-3H-indol-2-yl)phenol;2-(5,7-dichloro-3H-indol-2-yl)-4-fluorophenol;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,7-dichloro-2-[4-(trifluoromethyl)phenyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 159229384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).