Basic information
- Standard SMILES
Cc1cc(Nc2nccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)c2[N+](=O)[O-])nc(C)n1- InChIKey
FMZOFIHYMQBGPZ-UHFFFAOYSA-N- Molecular formula
- C19H13Cl2N7O3
- Average molar mass
- 458.3 g/mol
Names & identifiers
- Preferred name
- 2,6-dichloro-4-cyano-N-(2-(2,6-dimethylpyrimidin-4-ylamino)-3-nitropyridin-4-yl)benzamide
- IUPAC
- 2,6-dichloro-4-cyano-N-[2-[(2,6-dimethylpyrimidin-4-yl)amino]-3-nitro-4-pyridinyl]benzamide
Names & synonyms
SCHEMBL1707079FMZOFIHYMQBGPZ-UHFFFAOYSA-N2,6-dichloro-4-cyano-N-(2-(2,6-dimethylpyrimidin-4-ylamino)-3-nitropyridin-4-yl)benzamide
Database identifiers
- PubChem CID
- 59618406
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 702
Related reactions
2 records
Compound notes
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