Basic information
- CAS
870483-51-5- Standard SMILES
NCCC[C@H](N)C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)Nc1ccc2ncccc2c1- InChIKey
GUEZAAFKSGWWRH-PZJWPPBQSA-N- Molecular formula
- C23H26FN5O2
- Average molar mass
- 423.5 g/mol
- Monoisotopic mass
- 423.20705325
Names & identifiers
- Preferred name
- L-Ornithyl-4-fluoro-N-6-quinolinyl-D-phenylalaninamide
- IUPAC
- (2S)-2,5-diamino-N-[(2R)-3-(4-fluorophenyl)-1-oxo-1-(quinolin-6-ylamino)propan-2-yl]pentanamide
Names & synonyms
SCHEMBL1245390L-Ornithyl-4-fluoro-N-6-quinolinyl-D-phenylalaninamideDTXSID001207582870483-51-5L-Ornithyl-4-fluoro-N-quinolin-6-yl-D-phenylalaninamide
Database identifiers
- CAS
870483-51-5- PubChem CID
- 11568024
- DTXSID
DTXSID001207582
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 584
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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