2-(1H-benzimidazol-2-yl-thiomethyl)-benzothiazole

HCID 677910
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Basic information

Standard SMILES
c1ccc2[nH]c(SCc3nc4ccccc4s3)nc2c1
InChIKey
FLAMKNDYSOGEJE-UHFFFAOYSA-N
Molecular formula
C15H11N3S2
Average molar mass
297.4 g/mol

Names & identifiers

Preferred name
2-(1H-benzimidazol-2-yl-thiomethyl)-benzothiazole
IUPAC
2-(1H-benzimidazol-2-ylsulfanylmethyl)-1,3-benzothiazole

Names & synonyms

Oprea1_605772CHEMBL5278732SCHEMBL10365449FLAMKNDYSOGEJE-UHFFFAOYSA-NNSC827350NSC-8273502-(2-benzimidazolylthiomethyl)benzothiazole2-(1H-benzimidazol-2-yl-thiomethyl)-benzothiazoleAE-848/08335017Z196496281H-benzimidazol-2-yl 1,3-benzothiazol-2-ylmethyl sulfide

Database identifiers

PubChem CID
677910
ChEMBL
CHEMBL5278732

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
95.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
20

Related reactions

2 records
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Compound notes

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