2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole

C38H26N2 — CID 58057290

IUPAC2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole
SMILESc1ccc(-n2c(-c3ccc(-c4ccc(C5c6ccccc6-c6ccccc65)cc4)cc3)nc3ccccc32)cc1
InChIInChI=1S/C38H26N2/c1-2-10-30(11-3-1)40-36-17-9-8-16-35(36)39-38(40)29-24-20-27(21-25-29)26-18-22-28(23-19-26)37-33-14-6-4-12-31(33)32-13-5-7-15-34(32)37/h1-25,37H
InChIKeyOPDXGCHEJJOOOI-UHFFFAOYSA-N
MW510.64 g/mol
LogP9.52
Rot. Bonds4

About 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole

2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole (PubChem CID 58057290) has the molecular formula C38H26N2 and a molecular weight of 510.64 g/mol. Its IUPAC name is 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole
PubChem CID58057290
Molecular FormulaC38H26N2
Molecular Weight510.64 g/mol
Exact Mass510.21
IUPAC Name2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole
SMILESc1ccc(-n2c(-c3ccc(-c4ccc(C5c6ccccc6-c6ccccc65)cc4)cc3)nc3ccccc32)cc1
InChIInChI=1S/C38H26N2/c1-2-10-30(11-3-1)40-36-17-9-8-16-35(36)39-38(40)29-24-20-27(21-25-29)26-18-22-28(23-19-26)37-33-14-6-4-12-31(33)32-13-5-7-15-34(32)37/h1-25,37H
InChIKeyOPDXGCHEJJOOOI-UHFFFAOYSA-N
XLogP9.52
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.64
LogP ≤ 59.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
2-[4-[4,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 155186062
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
2-(4-bromophenyl)-1-phenylbenzimidazole
CID 23094070
1-phenyl-2-(2-phenylphenyl)benzimidazole
CID 139044287
1-phenyl-2-[4-[4-(1-phenylbenzimidazol-2-yl)phenoxy]phenyl]benzimidazole
CID 141099436
1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
1-phenyl-2-[4-[4-(2,3,4,5-tetraphenylpyrrol-1-yl)phenyl]phenyl]benzimidazole
CID 58489449
2-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-1-phenylbenzimidazole
CID 143828986
2-[2,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole
CID 141061579
2-[4-[4-[2,5-bis(4-methylphenyl)pyrrol-1-yl]phenyl]phenyl]-1-phenylbenzimidazole
CID 58489476
5,8-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]quinoxaline
CID 138705119

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole?
The IUPAC name of 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole (CID 58057290) is 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole.
What is the SMILES notation for 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole?
The canonical SMILES for 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole is c1ccc(-n2c(-c3ccc(-c4ccc(C5c6ccccc6-c6ccccc65)cc4)cc3)nc3ccccc32)cc1.
What is the InChIKey of 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole?
The InChIKey is OPDXGCHEJJOOOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26N2/c1-2-10-30(11-3-1)40-36-17-9-8-16-35(36)39-38(40)29-24-20-27(21-25-29)26-18-22-28(23-19-26)37-33-14-6-4-12-31(33)32-13-5-7-15-34(32)37/h1-25,37H.
What are the key properties of 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole?
2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole has a molecular weight of 510.64 g/mol, XLogP of 9.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(9H-fluoren-9-yl)phenyl]phenyl]-1-phenylbenzimidazole is sourced from PubChem (CID 58057290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).