Basic information
- Standard SMILES
N#Cc1ccc2c(c1)ncn2-c1cncc(Cl)n1- InChIKey
LLTGMVVIDVRPJH-UHFFFAOYSA-N- Molecular formula
- C12H6ClN5
- Average molar mass
- 255.66 g/mol
Names & identifiers
- Preferred name
- 1-(6-chloropyrazin-2-yl)-1H-benzimidazole-5-carbonitrile
- IUPAC
- 1-(6-chloropyrazin-2-yl)benzimidazole-5-carbonitrile
Names & synonyms
SCHEMBL3553511LLTGMVVIDVRPJH-UHFFFAOYSA-N1-(6-chloropyrazin-2-yl)-1H-benzimidazole-5-carbonitrile
Database identifiers
- PubChem CID
- 58869934
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 354
Related reactions
3 records
Compound notes
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