1-phenyl-2-thiophen-2-ylbenzimidazole

C17H12N2S — CID 19353962

IUPAC1-phenyl-2-thiophen-2-ylbenzimidazole
SMILESc1ccc(-n2c(-c3cccs3)nc3ccccc32)cc1
InChIInChI=1S/C17H12N2S/c1-2-7-13(8-3-1)19-15-10-5-4-9-14(15)18-17(19)16-11-6-12-20-16/h1-12H
InChIKeyPMNHJJOHONQZRG-UHFFFAOYSA-N
MW276.36 g/mol
LogP4.75
Rot. Bonds2

About 1-phenyl-2-thiophen-2-ylbenzimidazole

1-phenyl-2-thiophen-2-ylbenzimidazole (PubChem CID 19353962) has the molecular formula C17H12N2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 1-phenyl-2-thiophen-2-ylbenzimidazole.

Molecular Properties

Compound Name1-phenyl-2-thiophen-2-ylbenzimidazole
PubChem CID19353962
Molecular FormulaC17H12N2S
Molecular Weight276.36 g/mol
Exact Mass276.07
IUPAC Name1-phenyl-2-thiophen-2-ylbenzimidazole
SMILESc1ccc(-n2c(-c3cccs3)nc3ccccc32)cc1
InChIInChI=1S/C17H12N2S/c1-2-7-13(8-3-1)19-15-10-5-4-9-14(15)18-17(19)16-11-6-12-20-16/h1-12H
InChIKeyPMNHJJOHONQZRG-UHFFFAOYSA-N
XLogP4.75
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-phenyl-2-thiophen-2-ylbenzimidazole 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

1-Phenylbenzimidazole deriv. 51
CID 639427
2-(5-Methyl-2-thienyl)-1H-benzimidazole
CID 870214
2-(2-thienyl)-1H-benzimidazole
CID 506600
5-(methylsulfanyl)-1-phenyl-1H-1,3-benzodiazole
CID 5328514
1-Methyl-2-thiophen-2-ylbenzimidazole
CID 931177
2-(1H-benzimidazol-2-ylmethylsulfanyl)-1,3-benzothiazole
CID 380674
n-Methylthiabendazole
CID 612049
1-Isopropyl-2-thiophen-2-yl-1H-benzoimidazole
CID 949166
(1-Phenyl-1H-benzoimidazol-5-yl)-thiophen-2-ylmethyl-amine
CID 950037
1H-1,3-benzimidazol-2-ylmethyl phenyl sulfide
CID 1486498
6-Thiophen-2-yl-6,12-dihydrobenzimidazolo[1,2-c]quinazoline
CID 3818611
3-(2-Methoxyethyl)-2-thiophen-2-ylimidazo[4,5-b]quinoxaline
CID 1947381

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-thiophen-2-ylbenzimidazole?
The IUPAC name of 1-phenyl-2-thiophen-2-ylbenzimidazole (CID 19353962) is 1-phenyl-2-thiophen-2-ylbenzimidazole.
What is the SMILES notation for 1-phenyl-2-thiophen-2-ylbenzimidazole?
The canonical SMILES for 1-phenyl-2-thiophen-2-ylbenzimidazole is c1ccc(-n2c(-c3cccs3)nc3ccccc32)cc1.
What is the InChIKey of 1-phenyl-2-thiophen-2-ylbenzimidazole?
The InChIKey is PMNHJJOHONQZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2S/c1-2-7-13(8-3-1)19-15-10-5-4-9-14(15)18-17(19)16-11-6-12-20-16/h1-12H.
What are the key properties of 1-phenyl-2-thiophen-2-ylbenzimidazole?
1-phenyl-2-thiophen-2-ylbenzimidazole has a molecular weight of 276.36 g/mol, XLogP of 4.75, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-thiophen-2-ylbenzimidazole is sourced from PubChem (CID 19353962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).