9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole

C50H33N5 — CID 58500891

IUPAC9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
SMILESc1ccc(-n2c(-c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c(-c4nc5ccccc5n4-c4ccccc4)c3)nc3ccccc32)cc1
InChIInChI=1S/C50H33N5/c1-3-17-36(18-4-1)54-47-28-13-9-24-43(47)51-49(54)35-30-31-39(42(33-35)50-52-44-25-10-14-29-48(44)55(50)37-19-5-2-6-20-37)34-16-15-21-38(32-34)53-45-26-11-7-22-40(45)41-23-8-12-27-46(41)53/h1-33H
InChIKeyHBAUEIORDOGZJX-UHFFFAOYSA-N
MW703.85 g/mol
LogP12.46
Rot. Bonds6

About 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole

9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole (PubChem CID 58500891) has the molecular formula C50H33N5 and a molecular weight of 703.85 g/mol. Its IUPAC name is 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole.

Molecular Properties

Compound Name9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
PubChem CID58500891
Molecular FormulaC50H33N5
Molecular Weight703.85 g/mol
Exact Mass703.27
IUPAC Name9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
SMILESc1ccc(-n2c(-c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c(-c4nc5ccccc5n4-c4ccccc4)c3)nc3ccccc32)cc1
InChIInChI=1S/C50H33N5/c1-3-17-36(18-4-1)54-47-28-13-9-24-43(47)51-49(54)35-30-31-39(42(33-35)50-52-44-25-10-14-29-48(44)55(50)37-19-5-2-6-20-37)34-16-15-21-38(32-34)53-45-26-11-7-22-40(45)41-23-8-12-27-46(41)53/h1-33H
InChIKeyHBAUEIORDOGZJX-UHFFFAOYSA-N
XLogP12.46
TPSA40.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500703.85
LogP ≤ 512.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole 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

2-carbazol-9-yl-9-[3-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 144777561
2-[2,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole
CID 141061579
9-[3-(1-phenylbenzimidazol-2-yl)phenyl]-3-(2,6,8-triphenyldibenzofuran-4-yl)carbazole
CID 67818598
3-[3-[2-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]benzimidazol-1-yl]phenyl]-9-[3,5-di(carbazol-9-yl)phenyl]carbazole
CID 126493490
9-phenyl-1,3-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 118448479
9-[3-[10-(3-carbazol-9-ylphenyl)-2-[10-[6-(1-phenylbenzimidazol-2-yl)naphthalen-2-yl]anthracen-9-yl]anthracen-9-yl]phenyl]carbazole
CID 58963335
9-[4-[6-[3-carbazol-9-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-2-pyridinyl]phenyl]carbazole
CID 58500865
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
9-[4-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
CID 58500868
9-phenyl-3-[7-(1-phenylbenzimidazol-2-yl)triphenylen-2-yl]carbazole
CID 169294130
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[1-(3-phenylphenyl)benzimidazol-2-yl]phenyl]carbazole
CID 148971314
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 121307195

Frequently Asked Questions

What is the IUPAC name of 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
The IUPAC name of 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole (CID 58500891) is 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole.
What is the SMILES notation for 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
The canonical SMILES for 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole is c1ccc(-n2c(-c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c(-c4nc5ccccc5n4-c4ccccc4)c3)nc3ccccc32)cc1.
What is the InChIKey of 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
The InChIKey is HBAUEIORDOGZJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H33N5/c1-3-17-36(18-4-1)54-47-28-13-9-24-43(47)51-49(54)35-30-31-39(42(33-35)50-52-44-25-10-14-29-48(44)55(50)37-19-5-2-6-20-37)34-16-15-21-38(32-34)53-45-26-11-7-22-40(45)41-23-8-12-27-46(41)53/h1-33H.
What are the key properties of 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole has a molecular weight of 703.85 g/mol, XLogP of 12.46, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[2,4-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole is sourced from PubChem (CID 58500891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).