Basic information
- Standard SMILES
Cc1c(N[C@@H](C(=O)NNC(=O)c2ccc(O)c(Cl)c2)[C@H](C)O)ccc(C#N)c1Cl- InChIKey
VZUKJBROQLWWAC-DYZYQPBXSA-N- Molecular formula
- C19H18Cl2N4O4
- Average molar mass
- 437.3 g/mol
- Monoisotopic mass
- 436.0705105
Names & identifiers
- Preferred name
- N'-((2R,3S)-2-(3-Chloro-4-cyano-2-methylphenylamino)-3-hydroxybutanoyl)-3-chloro-4-hydroxybenzohydrazide
- IUPAC
- 3-chloro-N'-[(2R,3S)-2-(3-chloro-4-cyano-2-methylanilino)-3-hydroxybutanoyl]-4-hydroxybenzohydrazide
Names & synonyms
SCHEMBL1363643VZUKJBROQLWWAC-DYZYQPBXSA-NN'-((2R,3S)-2-(3-Chloro-4-cyano-2-methylphenylamino)-3-hydroxybutanoyl)-3-chloro-4-hydroxybenzohydrazide
Database identifiers
- PubChem CID
- 67006146
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 643
Related reactions
3 records
Compound notes
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