Basic information
- Standard SMILES
CC(=O)c1c(N)c2cc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)nc2n(C)c1=O- InChIKey
PCAFDAFQSCZHCE-UHFFFAOYSA-N- Molecular formula
- C23H16Cl3N3O2
- Average molar mass
- 472.7 g/mol
- Monoisotopic mass
- 471.03081
Names & identifiers
- Preferred name
- 3-acetyl-4-amino-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-1-methyl-1,8-naphthyridin-2(1H)-one
- IUPAC
- 3-acetyl-4-amino-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-1-methyl-1,8-naphthyridin-2-one
Names & synonyms
CHEMBL2038113-acetyl-4-amino-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-1-methyl-1,8-naphthyridin-2(1H)-oneSCHEMBL3624388PCAFDAFQSCZHCE-UHFFFAOYSA-NBDBM50176432
Database identifiers
- PubChem CID
- 11260007
- ChEMBL
CHEMBL203811
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 76.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 752
Related reactions
13 records
Compound notes
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