Carbamic acid, (4-(methyl(phenylmethyl)amino)-2,3,4-trioxo-1-(phenylmethyl)butyl)-, phenylmethyl ester
Basic information
- CAS
136226-17-0- Standard SMILES
CN(Cc1ccccc1)C(=O)C(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1- InChIKey
APIFHNMHDDKVGD-QHCPKHFHSA-N- Molecular formula
- C27H26N2O5
- Average molar mass
- 458.5 g/mol
- Monoisotopic mass
- 458.18417193
Names & identifiers
- Preferred name
- Carbamic acid, (4-(methyl(phenylmethyl)amino)-2,3,4-trioxo-1-(phenylmethyl)butyl)-, phenylmethyl ester
- IUPAC
- benzyl N-[(2S)-5-[benzyl(methyl)amino]-3,4,5-trioxo-1-phenylpentan-2-yl]carbamate
Names & synonyms
136226-17-0Carbamic acid, (4-(methyl(phenylmethyl)amino)-2,3,4-trioxo-1-(phenylmethyl)butyl)-, phenylmethyl esterCarbamic acid, [4-[methyl(phenylmethyl)amino]-2,3,4-trioxo-1-(phenylmethyl)butyl]-, phenylmethyl esterDTXSID70159736Benzyl {(2S)-5-[benzyl(methyl)amino]-3,4,5-trioxo-1-phenylpentan-2-yl}carbamatebenzyl N-[(1S)-1-benzyl-4-[benzyl(methyl)amino]-2,3,4-trioxo-butyl]carbamate
Database identifiers
- CAS
136226-17-0- PubChem CID
- 454622
- DTXSID
DTXSID70159736
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 691
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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