N-[3-(4-chlorophenyl)-1-methyl-4-oxoquinolin-2-yl]acetamide
Basic information
- CAS
900869-69-4- Standard SMILES
CC(=O)Nc1c(-c2ccc(Cl)cc2)c(=O)c2ccccc2n1C- InChIKey
YCPBMKBFGRJSCC-UHFFFAOYSA-N- Molecular formula
- C18H15ClN2O2
- Average molar mass
- 326.8 g/mol
- Monoisotopic mass
- 326.0822054
Names & identifiers
- Preferred name
- N-[3-(4-chlorophenyl)-1-methyl-4-oxoquinolin-2-yl]acetamide
- IUPAC
- N-[3-(4-chlorophenyl)-1-methyl-4-oxoquinolin-2-yl]acetamide
Names & synonyms
N-[3-(4-chlorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]acetamideN-(3-(4-chlorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl)acetamideN-[3-(4-chlorophenyl)-1-methyl-4-oxoquinolin-2-yl]acetamide900869-69-4MLS001214461CHEMBL1889674DTXSID601324037HMS2857H03STK590243AKOS005512539SMR000543779
Database identifiers
- CAS
900869-69-4- PubChem CID
- 4909129
- DTXSID
DTXSID601324037- ChEMBL
CHEMBL1889674
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 523
Experimental & physicochemical properties
Solubility14.8 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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