N-(4-{[(2H-Benzimidazol-2-ylidene)methyl]amino}phenyl)acetamide

HCID 136229016

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Basic information

CAS: 819858-19-0
Standard SMILES: CC(=O)Nc1ccc(N=Cc2nc3ccccc3[nH]2)cc1
InChIKey: PNRDQJMQMSKQKQ-UHFFFAOYSA-N
Molecular formula: C16H14N4O
Average molar mass: 278.31 g/mol
Monoisotopic mass: 278.11676108

Names & identifiers

Preferred name: N-(4-{[(2H-Benzimidazol-2-ylidene)methyl]amino}phenyl)acetamide
IUPAC: N-[4-(1H-benzimidazol-2-ylmethylideneamino)phenyl]acetamide

Names & synonyms

819858-19-0N-(4-(((1H-Benzo[d]imidazol-2-yl)methylene)amino)phenyl)acetamideDTXSID60839853N-(4-{[(2H-Benzimidazol-2-ylidene)methyl]amino}phenyl)acetamideN-(4-{[(2H-1,3-Benzimidazol-2-ylidene)methyl]amino}phenyl)acetamide

Database identifiers

CAS: 819858-19-0
PubChem CID: 136229016
DTXSID: DTXSID60839853

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 70.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 21
Formal charge: 0
Complexity: 390

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