Basic information
- Standard SMILES
N[C@@H](COCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2)c(Cl)c1- InChIKey
DUPRGLUCXBMHOX-FQEVSTJZSA-N- Molecular formula
- C22H21ClN2O3
- Average molar mass
- 396.9 g/mol
Names & identifiers
- Preferred name
- (S)-2-amino-3-(benzyloxy)-N-(3-chloro-4-phenoxyphenyl)propanamide
- IUPAC
- (2S)-2-amino-N-(3-chloro-4-phenoxyphenyl)-3-phenylmethoxypropanamide
Names & synonyms
SCHEMBL1372228DUPRGLUCXBMHOX-FQEVSTJZSA-N(S)-2-amino-3-(benzyloxy)-N-(3-chloro-4-phenoxyphenyl)propanamide
Database identifiers
- PubChem CID
- 67009397
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 467
Related reactions
1 records
Compound notes
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