Basic information
- Standard SMILES
COC(=O)[C@@H](N)CCCNC(=O)OCc1ccccc1- InChIKey
BJNJTVSXZUTHRA-LBPRGKRZSA-N- Molecular formula
- C14H20N2O4
- Average molar mass
- 280.32 g/mol
- Monoisotopic mass
- 280.14230712
Names & identifiers
- Preferred name
- (S)-2-Amino-5-benzyloxycarbonylamino-pentanoic acid methyl ester
- IUPAC
- methyl (2S)-2-amino-5-(phenylmethoxycarbonylamino)pentanoate
Names & synonyms
H-Orn(Z)-OMeSCHEMBL1586581BJNJTVSXZUTHRA-LBPRGKRZSA-NNdelta-benzyloxycarbonyl-L-ornithine methyl estermethyl (2S)-2-amino-5-{[(benzyloxy)carbonyl]amino}pentanoateMethyl (S)-2-amino-5-(((benzyloxy)carbonyl)amino)pentanoate(S)-2-Amino-5-benzyloxycarbonylamino-pentanoic acid methyl ester62631-17-8
Database identifiers
- PubChem CID
- 7018807
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 304
Related reactions
5 records
Compound notes
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