1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole

C23H16N2S — CID 23527743

IUPAC1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole
SMILESc1ccc(-c2ccc(-c3nc4ccccc4n3-c3ccccc3)s2)cc1
InChIInChI=1S/C23H16N2S/c1-3-9-17(10-4-1)21-15-16-22(26-21)23-24-19-13-7-8-14-20(19)25(23)18-11-5-2-6-12-18/h1-16H
InChIKeySVQVSLJQWNUDDS-UHFFFAOYSA-N
MW352.46 g/mol
LogP6.42
Rot. Bonds3

About 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole

1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole (PubChem CID 23527743) has the molecular formula C23H16N2S and a molecular weight of 352.46 g/mol. Its IUPAC name is 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole.

Molecular Properties

Compound Name1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole
PubChem CID23527743
Molecular FormulaC23H16N2S
Molecular Weight352.46 g/mol
Exact Mass352.10
IUPAC Name1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole
SMILESc1ccc(-c2ccc(-c3nc4ccccc4n3-c3ccccc3)s2)cc1
InChIInChI=1S/C23H16N2S/c1-3-9-17(10-4-1)21-15-16-22(26-21)23-24-19-13-7-8-14-20(19)25(23)18-11-5-2-6-12-18/h1-16H
InChIKeySVQVSLJQWNUDDS-UHFFFAOYSA-N
XLogP6.42
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.46
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
1-phenyl-2-(2-phenylphenyl)benzimidazole
CID 139044287
1-phenyl-2-[4-[9-phenyl-2,7-bis(5-phenylthiophen-2-yl)fluoren-9-yl]phenyl]benzimidazole
CID 59245495
2-(1-benzothiophen-2-yl)-1-phenylbenzimidazole
CID 134337994
2-[4-[4,8-diphenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]thieno[2,3-f][1]benzothiol-6-yl]phenyl]-1-phenylbenzimidazole
CID 134595234
1,2-diphenylbenzimidazole;ethane;iridium;propane
CID 142394497
2-[4-[4,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 155186062
1-phenyl-2-pyridin-3-ylbenzimidazole
CID 24821366
N,N-diphenyl-3-(1-phenylbenzimidazol-2-yl)aniline
CID 146339319
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581
2-(4-bromophenyl)-1-phenylbenzimidazole
CID 23094070

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole?
The IUPAC name of 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole (CID 23527743) is 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole.
What is the SMILES notation for 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole?
The canonical SMILES for 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole is c1ccc(-c2ccc(-c3nc4ccccc4n3-c3ccccc3)s2)cc1.
What is the InChIKey of 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole?
The InChIKey is SVQVSLJQWNUDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2S/c1-3-9-17(10-4-1)21-15-16-22(26-21)23-24-19-13-7-8-14-20(19)25(23)18-11-5-2-6-12-18/h1-16H.
What are the key properties of 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole?
1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole has a molecular weight of 352.46 g/mol, XLogP of 6.42, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(5-phenylthiophen-2-yl)benzimidazole is sourced from PubChem (CID 23527743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).