Basic information
- Standard SMILES
CCCC(=O)c1cnc2c(COC(=O)c3ccc(OC)cc3)cccc2c1Nc1ccc(O)cc1C- InChIKey
PPQKPGBMXJLONH-UHFFFAOYSA-N- Molecular formula
- C29H28N2O5
- Average molar mass
- 484.5 g/mol
Names & identifiers
- Preferred name
- 3-Butyryl-4-(4-hydroxy-2-methylphenylamino)-8-(4-methoxybenzoyloxymethyl)quinoline
- IUPAC
- [3-butanoyl-4-(4-hydroxy-2-methylanilino)quinolin-8-yl]methyl 4-methoxybenzoate
Names & synonyms
SCHEMBL9265761PPQKPGBMXJLONH-UHFFFAOYSA-N3-butyryl-4-(4-hydroxy-2-methylphenylamino)-8-(4-methoxybenzoyloxymethyl)-quinoline3-butyryl-4-(4-hydroxy-2-methylphenylamino)-8-(4-methoxybenzoyloxymethyl)quinoline
Database identifiers
- PubChem CID
- 19909677
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 97.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 724
Related reactions
5 records
Compound notes
Loading…