5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole

C40H26N4 — CID 147682919

IUPAC5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole
SMILESc1ccc2c(c1)c1ncccc1n2-c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)cc2)cc1
InChIInChI=1S/C40H26N4/c1-3-9-35-33(7-1)39-37(11-5-25-41-39)43(35)31-21-17-29(18-22-31)27-13-15-28(16-14-27)30-19-23-32(24-20-30)44-36-10-4-2-8-34(36)40-38(44)12-6-26-42-40/h1-26H
InChIKeyGPLVHLIPUUIYJI-UHFFFAOYSA-N
MW562.68 g/mol
LogP10.00
Rot. Bonds4

About 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole

5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole (PubChem CID 147682919) has the molecular formula C40H26N4 and a molecular weight of 562.68 g/mol. Its IUPAC name is 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole.

Molecular Properties

Compound Name5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole
PubChem CID147682919
Molecular FormulaC40H26N4
Molecular Weight562.68 g/mol
Exact Mass562.22
IUPAC Name5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole
SMILESc1ccc2c(c1)c1ncccc1n2-c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)cc2)cc1
InChIInChI=1S/C40H26N4/c1-3-9-35-33(7-1)39-37(11-5-25-41-39)43(35)31-21-17-29(18-22-31)27-13-15-28(16-14-27)30-19-23-32(24-20-30)44-36-10-4-2-8-34(36)40-38(44)12-6-26-42-40/h1-26H
InChIKeyGPLVHLIPUUIYJI-UHFFFAOYSA-N
XLogP10.00
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.68
LogP ≤ 510.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-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

8-[4-[4-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 118517438
5-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]pyrido[3,2-b]indole
CID 142725070
8-methyl-5-(4-phenylphenyl)pyrido[3,2-b]indole
CID 144976361
5-[4-[4-(3,4-dihydropyrido[3,2-b]indol-5-yl)phenyl]phenyl]pyrido[3,2-b]indole
CID 147276427
7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole
CID 129221390
5-pyridin-3-ylpyrido[3,2-b]indole
CID 59459758
6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine
CID 163816869
5-[4-[6-[6-(4-pyrido[3,2-b]indol-5-ylphenyl)-2-pyridinyl]-2-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 58098979
8-(9-phenylcarbazol-2-yl)-5-(3-phenylphenyl)pyrido[3,2-b]indole;8-(9-phenylcarbazol-2-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole;5-(3-phenylphenyl)-8-[9-(4-phenylphenyl)carbazol-2-yl]pyrido[3,2-b]indole
CID 161395661
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
5-[4-(2-naphthalen-1-yl-6-pyridin-2-yl-4-pyridinyl)phenyl]pyrido[3,2-b]indole
CID 59326017

Frequently Asked Questions

What is the IUPAC name of 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole?
The IUPAC name of 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole (CID 147682919) is 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole.
What is the SMILES notation for 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole?
The canonical SMILES for 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole is c1ccc2c(c1)c1ncccc1n2-c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)cc2)cc1.
What is the InChIKey of 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole?
The InChIKey is GPLVHLIPUUIYJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26N4/c1-3-9-35-33(7-1)39-37(11-5-25-41-39)43(35)31-21-17-29(18-22-31)27-13-15-28(16-14-27)30-19-23-32(24-20-30)44-36-10-4-2-8-34(36)40-38(44)12-6-26-42-40/h1-26H.
What are the key properties of 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole?
5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole has a molecular weight of 562.68 g/mol, XLogP of 10.00, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole is sourced from PubChem (CID 147682919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).