Basic information
- Standard SMILES
O=C(O)C[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)c1ccnc(C(=O)O)c1- InChIKey
LUPIIIGDIGDNTK-LJQANCHMSA-N- Molecular formula
- C23H20N2O5
- Average molar mass
- 404.4 g/mol
Names & identifiers
- Preferred name
- (R)-4-(1-(biphenyl-4-yl)-3-carboxypropan-2-ylcarbamoyl)picolinic acid
- IUPAC
- 4-[[(2R)-1-carboxy-3-(4-phenylphenyl)propan-2-yl]carbamoyl]pyridine-2-carboxylic acid
Names & synonyms
SCHEMBL2869942LUPIIIGDIGDNTK-LJQANCHMSA-N(R)-4-(1-(biphenyl-4-yl)-3-carboxypropan-2-ylcarbamoyl)picolinic acid
Database identifiers
- PubChem CID
- 59607919
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 596
Related reactions
2 records
Compound notes
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