Basic information
- Standard SMILES
O=C(N[C@@H](CC1CCCCC1)C(=O)NCCO)OCc1ccccc1- InChIKey
KUAWCATXAGLAIE-KRWDZBQOSA-N- Molecular formula
- C19H28N2O4
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.20490738
Names & identifiers
- Preferred name
- (S)-[2-Cyclohexyl-1-(2-hydroxy-ethylcarbamoyl)-ethyl]-carbamic acid benzyl ester
- IUPAC
- benzyl N-[(2S)-3-cyclohexyl-1-(2-hydroxyethylamino)-1-oxopropan-2-yl]carbamate
Names & synonyms
SCHEMBL5841881KUAWCATXAGLAIE-KRWDZBQOSA-N(S)-[2-Cyclohexyl-1-(2-hydroxy-ethylcarbamoyl)-ethyl]-carbamic acid benzyl ester
Database identifiers
- PubChem CID
- 58700154
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 404
Related reactions
2 records
Compound notes
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