2-(1H-Benzimidazol-2-yl)-1,3-benzothiazole

HCID 373878

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Basic information

Standard SMILES: c1ccc2[nH]c(-c3nc4ccccc4s3)nc2c1
InChIKey: IIBOKVBFKUNLNA-UHFFFAOYSA-N
Molecular formula: C14H9N3S
Average molar mass: 251.31 g/mol

Overview

2-(1H-benzimidazol-2-yl)-1,3-benzothiazole is a member of benzothiazoles.

Names & identifiers

Preferred name: 2-(1H-Benzimidazol-2-yl)-1,3-benzothiazole
IUPAC: 2-(1H-benzimidazol-2-yl)-1,3-benzothiazole

Names & synonyms

2-(1H-Benzimidazol-2-yl)-1,3-benzothiazoleNSC650841ChemDiv3_000460SCHEMBL824391CHEMBL40838412-benzimidazol-2-ylbenzothiazoleCHEBI:941302-(2-benzimidazolyl)benzothiazoleIIBOKVBFKUNLNA-UHFFFAOYSA-NHMS1474E20NSC838993AKOS003249382

Show more names

2-(1H-benzimidazol-2-yl)benzothiazoleNSC-650841NSC-838993ST45138784BRD-K83691318-001-01-6Q27165878Z277112100

Database identifiers

PubChem CID: 373878
ChEMBL: CHEMBL4083841
ChEBI: CHEBI:94130

Properties

Computed structural properties

XLogP: 3.6
Topological polar surface area: 69.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 18
Formal charge: 0
Complexity: 311

Related reactions

1 records

New reaction record

HRID 324917As productuspto-grants-2001_04

Compound notes

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