Basic information
- Standard SMILES
Cc1cc(C(=O)O)cc(C)c1NC(=O)c1cc(N2CCC(O)CC2)nc2ccccc12- InChIKey
JCTRNVCTGCQZAH-UHFFFAOYSA-N- Molecular formula
- C24H25N3O4
- Average molar mass
- 419.5 g/mol
Names & identifiers
- Preferred name
- 4-[[2-(4-Hydroxy-1-Piperidyl)Quinoline-4-carbonyl]amino]-3,5-dimethyl-benzoic acid
- IUPAC
- 4-[[2-(4-hydroxypiperidin-1-yl)quinoline-4-carbonyl]amino]-3,5-dimethylbenzoic acid
Names & synonyms
1529761-36-1SCHEMBL15398640JCTRNVCTGCQZAH-UHFFFAOYSA-N4-[[2-(4-Hydroxy-1-Piperidyl)Quinoline-4-carbonyl]amino]-3,5-dimethyl-benzoic acidDA-44094
Database identifiers
- PubChem CID
- 86707366
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 639
Related reactions
2 records
Compound notes
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