Basic information
- CAS
72724-87-9- Standard SMILES
CC(=O)NC(CCCCNC(=O)OCc1ccccc1)C(=O)NCC(=O)O- InChIKey
XMBALOPFHUNRAP-UHFFFAOYSA-N- Molecular formula
- C18H25N3O6
- Average molar mass
- 379.4 g/mol
- Monoisotopic mass
- 379.17433553
Names & identifiers
- Preferred name
- 2-[(2-Acetamido-6-phenylmethoxycarbonylamino-hexanoyl)amino]acetic acid
- IUPAC
- 2-[[2-acetamido-6-(phenylmethoxycarbonylamino)hexanoyl]amino]acetic acid
Names & synonyms
72724-87-9NSC3399282-[(2-acetamido-6-phenylmethoxycarbonylamino-hexanoyl)amino]acetic acidDTXSID70319116NSC-339928DS-012663N~2~-Acetyl-N~6~-[(benzyloxy)carbonyl]lysylglycine
Database identifiers
- CAS
72724-87-9- PubChem CID
- 334522
- DTXSID
DTXSID70319116
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 505
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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