Basic information
- Standard SMILES
CCOC(=O)c1c(C)nc2cccc(OCC(CC)NC(=O)c3cc(O)cc(O)c3)c2c1N- InChIKey
HBBUQZURYHCSFC-UHFFFAOYSA-N- Molecular formula
- C24H27N3O6
- Average molar mass
- 453.5 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-amino-5-[2-[(3,5-dihydroxybenzoyl)amino]butoxy]-2-methylquinoline-3-carboxylate
- IUPAC
- ethyl 4-amino-5-[2-[(3,5-dihydroxybenzoyl)amino]butoxy]-2-methylquinoline-3-carboxylate
Names & synonyms
SCHEMBL28451357
Database identifiers
- PubChem CID
- 123491645
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 654
Related reactions
1 records
Linked notes
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