Benzeneacetamide, N-(4-((3,5-dimethylphenyl)thio)-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl)-
Basic information
- CAS
172470-02-9- Standard SMILES
Cc1cc(C)cc(Sc2c(C)c[nH]c(=O)c2NC(=O)Cc2ccccc2)c1- InChIKey
RICRLAMHMKSDTK-UHFFFAOYSA-N- Molecular formula
- C22H22N2O2S
- Average molar mass
- 378.5 g/mol
- Monoisotopic mass
- 378.14019912
Names & identifiers
- Preferred name
- Benzeneacetamide, N-(4-((3,5-dimethylphenyl)thio)-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl)-
- IUPAC
- N-[4-(3,5-dimethylphenyl)sulfanyl-5-methyl-2-oxo-1H-pyridin-3-yl]-2-phenylacetamide
Names & synonyms
172470-02-9Benzeneacetamide, N-(4-((3,5-dimethylphenyl)thio)-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl)-Benzeneacetamide, N-[4-[(3,5-dimethylphenyl)thio]-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl]-CHEMBL358094SCHEMBL7013231DTXSID701693153-(BnCONH)-2-Pyridinone, PhS deriv.N-{4-[(3,5-dimethylphenyl)sulfanyl]-5-methyl-2-oxo-1,2-dihydropyridin-3-yl}-2-phenylacetamideN-[4-(3,5-dimethylphenyl)sulfanyl-5-methyl-2-oxo-1H-pyridin-3-yl]-2-phenyl-acetamide
Database identifiers
- CAS
172470-02-9- PubChem CID
- 464598
- DTXSID
DTXSID70169315- ChEMBL
CHEMBL358094- Nikkaji
- J713.242E
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 624
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Compound notes
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