Basic information
- Standard SMILES
Nc1ccc(CNn2cnc3ccccc32)cc1- InChIKey
JWHIIOKQNOHASJ-UHFFFAOYSA-N- Molecular formula
- C14H14N4
- Average molar mass
- 238.29 g/mol
Names & identifiers
- Preferred name
- N-(4-aminobenzyl)amino-1H-benzimidazole
- IUPAC
- N-[(4-aminophenyl)methyl]benzimidazol-1-amine
Names & synonyms
SCHEMBL3236152JWHIIOKQNOHASJ-UHFFFAOYSA-NN-(4-aminobenzyl)amino-1H-benzimidazole
Database identifiers
- PubChem CID
- 17864618
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 55.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 263
Related reactions
2 records
Compound notes
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