1-(1-benzothiophen-2-yl)benzimidazole

C15H10N2S — CID 90680843

IUPAC1-(1-benzothiophen-2-yl)benzimidazole
SMILESc1ccc2sc(-n3cnc4ccccc43)cc2c1
InChIInChI=1S/C15H10N2S/c1-4-8-14-11(5-1)9-15(18-14)17-10-16-12-6-2-3-7-13(12)17/h1-10H
InChIKeyNUVBNZPAKXQCHW-UHFFFAOYSA-N
MW250.33 g/mol
LogP4.24
Rot. Bonds1

About 1-(1-benzothiophen-2-yl)benzimidazole

1-(1-benzothiophen-2-yl)benzimidazole (PubChem CID 90680843) has the molecular formula C15H10N2S and a molecular weight of 250.33 g/mol. Its IUPAC name is 1-(1-benzothiophen-2-yl)benzimidazole.

Molecular Properties

Compound Name1-(1-benzothiophen-2-yl)benzimidazole
PubChem CID90680843
Molecular FormulaC15H10N2S
Molecular Weight250.33 g/mol
Exact Mass250.06
IUPAC Name1-(1-benzothiophen-2-yl)benzimidazole
SMILESc1ccc2sc(-n3cnc4ccccc43)cc2c1
InChIInChI=1S/C15H10N2S/c1-4-8-14-11(5-1)9-15(18-14)17-10-16-12-6-2-3-7-13(12)17/h1-10H
InChIKeyNUVBNZPAKXQCHW-UHFFFAOYSA-N
XLogP4.24
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-benzothiophen-2-yl)benzimidazole?
The IUPAC name of 1-(1-benzothiophen-2-yl)benzimidazole (CID 90680843) is 1-(1-benzothiophen-2-yl)benzimidazole.
What is the SMILES notation for 1-(1-benzothiophen-2-yl)benzimidazole?
The canonical SMILES for 1-(1-benzothiophen-2-yl)benzimidazole is c1ccc2sc(-n3cnc4ccccc43)cc2c1.
What is the InChIKey of 1-(1-benzothiophen-2-yl)benzimidazole?
The InChIKey is NUVBNZPAKXQCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2S/c1-4-8-14-11(5-1)9-15(18-14)17-10-16-12-6-2-3-7-13(12)17/h1-10H.
What are the key properties of 1-(1-benzothiophen-2-yl)benzimidazole?
1-(1-benzothiophen-2-yl)benzimidazole has a molecular weight of 250.33 g/mol, XLogP of 4.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzothiophen-2-yl)benzimidazole is sourced from PubChem (CID 90680843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).