Basic information
- CAS
50903-77-0- Standard SMILES
CCC(C)C(NC(=O)C1CCCN1C(=O)OCc1ccccc1)C(=O)O- InChIKey
RGPFRWHTVUVNAT-UHFFFAOYSA-N- Molecular formula
- C19H26N2O5
- Average molar mass
- 362.4 g/mol
- Monoisotopic mass
- 362.18417193
Names & identifiers
- Preferred name
- 1-((Benzyloxy)carbonyl)prolylisoleucine
- IUPAC
- 3-methyl-2-[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]pentanoic acid
Names & synonyms
1-((Benzyloxy)carbonyl)prolylisoleucine50903-77-0NSC334029NSC 3340291-[(Benzyloxy)carbonyl]prolylisoleucineDTXSID70965157NSC-334029N-[{1-[(Benzyloxy)carbonyl]pyrrolidin-2-yl}(hydroxy)methylidene]isoleucine2-[(1-benzyloxycarbonylpyrrolidine-2-carbonyl)amino]-3-methyl-pentanoic acid
Database identifiers
- CAS
50903-77-0- PubChem CID
- 333360
- DTXSID
DTXSID70965157
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 95.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 504
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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