3-Butyryl-4-(4-hydroxy-2-methylphenylamino)-8-(4-methoxybenzoyloxymethyl)quinoline

HCID 19909677

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

Related reactions

5 records

Compound notes

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