N-[(2S)-1-(3-chloro-4-methoxyanilino)-3-methyl-1-oxobutan-2-yl]benzamide
Basic information
- CAS
956544-15-3- Standard SMILES
COc1ccc(NC(=O)[C@@H](NC(=O)c2ccccc2)C(C)C)cc1Cl- InChIKey
XDZPDYABAUAXIA-KRWDZBQOSA-N- Molecular formula
- C19H21ClN2O3
- Average molar mass
- 360.8 g/mol
- Monoisotopic mass
- 360.1240702
Names & identifiers
- Preferred name
- N-[(2S)-1-(3-chloro-4-methoxyanilino)-3-methyl-1-oxobutan-2-yl]benzamide
- IUPAC
- N-[(2S)-1-(3-chloro-4-methoxyanilino)-3-methyl-1-oxobutan-2-yl]benzamide
Names & synonyms
DTXSID501137281AKOS034828820N-[(2S)-1-(3-chloro-4-methoxyanilino)-3-methyl-1-oxobutan-2-yl]benzamideN-[(1S)-1-[[(3-Chloro-4-methoxyphenyl)amino]carbonyl]-2-methylpropyl]benzamide956544-15-3Z90289859
Database identifiers
- CAS
956544-15-3- PubChem CID
- 2590835
- DTXSID
DTXSID501137281
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 452
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Compound notes
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