Basic information
- CAS
174636-33-0- Standard SMILES
CC[C@@H](NC(=O)c1c(O)c(-c2ccccc2)nc2ccccc12)c1ccccc1- InChIKey
BIAVGWDGIJKWRM-HXUWFJFHSA-N- Molecular formula
- C25H22N2O2
- Average molar mass
- 382.5 g/mol
- Monoisotopic mass
- 382.16812795
Names & identifiers
- Preferred name
- 3-hydroxy-2-phenyl-N-[(1R)-1-phenylpropyl]quinoline-4-carboxamide
- IUPAC
- 3-hydroxy-2-phenyl-N-[(1R)-1-phenylpropyl]quinoline-4-carboxamide
Names & synonyms
CHEMBL430118174636-33-0SCHEMBL6449764DTXSID1011694643-hydroxy-2-phenyl-N-[(1R)-1-phenylpropyl]quinoline-4-carboxamideBDBM500747913-Hydroxy-2-phenyl-N-[(1R)-1-phenylpropyl]-4-quinolinecarboxamide3-Hydroxy-2-phenyl-quinoline-4-carboxylic acid ((R)-1-phenyl-propyl)-amide
Database identifiers
- CAS
174636-33-0- PubChem CID
- 10691318
- DTXSID
DTXSID101169464- ChEMBL
CHEMBL430118- Nikkaji
- J1.091.878B
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 527
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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