5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole

C34H24N4 — CID 58202938

IUPAC5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole
SMILESc1ccc(C(c2ccc(-n3c4ccccc4c4cnccc43)cc2)c2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C34H24N4/c1-2-8-24(9-3-1)34(26-15-18-31(37-22-26)30-11-6-7-20-36-30)25-13-16-27(17-14-25)38-32-12-5-4-10-28(32)29-23-35-21-19-33(29)38/h1-23,34H
InChIKeyGCAAUDLSFSJSTN-UHFFFAOYSA-N
MW488.59 g/mol
LogP7.82
Rot. Bonds5

About 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole

5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole (PubChem CID 58202938) has the molecular formula C34H24N4 and a molecular weight of 488.59 g/mol. Its IUPAC name is 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole.

Molecular Properties

Compound Name5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole
PubChem CID58202938
Molecular FormulaC34H24N4
Molecular Weight488.59 g/mol
Exact Mass488.20
IUPAC Name5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole
SMILESc1ccc(C(c2ccc(-n3c4ccccc4c4cnccc43)cc2)c2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C34H24N4/c1-2-8-24(9-3-1)34(26-15-18-31(37-22-26)30-11-6-7-20-36-30)25-13-16-27(17-14-25)38-32-12-5-4-10-28(32)29-23-35-21-19-33(29)38/h1-23,34H
InChIKeyGCAAUDLSFSJSTN-UHFFFAOYSA-N
XLogP7.82
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.59
LogP ≤ 57.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-[6-(5-pyridin-2-yl-4-pyridin-4-yl-1,2,4-triazol-3-yl)-3-pyridinyl]carbazole
CID 59845031
5-[3-[2-(4-phenylphenyl)-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 59326106
8-carbazol-9-yl-5-phenylpyrido[4,3-b]indole
CID 149133438
9-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]pyrido[3,4-b]indole
CID 58750621
9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]pyrido[3,4-b]indole
CID 58750680
5-[3-[6-pyridin-2-yl-4-[10-(4-pyrido[4,3-b]indol-5-ylphenyl)anthracen-9-yl]-2-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 89119653
8-[4-[(4-carbazol-9-ylphenyl)methyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 59344139
5-[4-[6-[6-(4-pyrido[3,2-b]indol-5-ylphenyl)-2-pyridinyl]-2-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 58098979
5-[3-[6-[5-(4-pyrido[3,2-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 58099053
9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole
CID 139574913
9-[4-[4-(3-phenylphenyl)-6-pyridin-2-yl-2-pyridinyl]phenyl]pyrido[3,4-b]indole
CID 59325997
5-[4-[3-(4-pyrido[4,3-b]indol-5-ylphenyl)-2,2-bis[(4-pyrido[4,3-b]indol-5-ylphenyl)methyl]propyl]phenyl]pyrido[4,3-b]indole;5-[4-[[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]methyl]phenyl]pyrido[3,2-b]indole;9-[4-[[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]methyl]phenyl]pyrido[3,4-b]indole;5-[4-[[6-[5-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]-2-pyridinyl]-3-pyridinyl]methyl]phenyl]pyrido[3,2-b]indole;9-[4-[[6-[5-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]-2-pyridinyl]-3-pyridinyl]methyl]phenyl]pyrido[3,4-b]indole;8-[4-[3-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-2,2-bis[[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]methyl]propyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158927878

Frequently Asked Questions

What is the IUPAC name of 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole?
The IUPAC name of 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole (CID 58202938) is 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole.
What is the SMILES notation for 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole?
The canonical SMILES for 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole is c1ccc(C(c2ccc(-n3c4ccccc4c4cnccc43)cc2)c2ccc(-c3ccccn3)nc2)cc1.
What is the InChIKey of 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole?
The InChIKey is GCAAUDLSFSJSTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24N4/c1-2-8-24(9-3-1)34(26-15-18-31(37-22-26)30-11-6-7-20-36-30)25-13-16-27(17-14-25)38-32-12-5-4-10-28(32)29-23-35-21-19-33(29)38/h1-23,34H.
What are the key properties of 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole?
5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole has a molecular weight of 488.59 g/mol, XLogP of 7.82, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[phenyl-(6-pyridin-2-yl-3-pyridinyl)methyl]phenyl]pyrido[4,3-b]indole is sourced from PubChem (CID 58202938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).