2(1H)-Pyrimidinone, 4-chloro-6-[4-(methylsulfonyl)phenyl]-1-phenyl-
Basic information
- CAS
651316-46-0- Standard SMILES
CS(=O)(=O)c1ccc(-c2cc(Cl)nc(=O)n2-c2ccccc2)cc1- InChIKey
WDCUZRHHFPKGJP-UHFFFAOYSA-N- Molecular formula
- C17H13ClN2O3S
- Average molar mass
- 360.8 g/mol
- Monoisotopic mass
- 360.0335411
Names & identifiers
- Preferred name
- 2(1H)-Pyrimidinone, 4-chloro-6-[4-(methylsulfonyl)phenyl]-1-phenyl-
- IUPAC
- 4-chloro-6-(4-methylsulfonylphenyl)-1-phenylpyrimidin-2-one
Names & synonyms
651316-46-02(1H)-Pyrimidinone, 4-chloro-6-[4-(methylsulfonyl)phenyl]-1-phenyl-SCHEMBL1573194DTXSID104373234-Chloro-6-[4-(methanesulfonyl)phenyl]-1-phenylpyrimidin-2(1H)-one
Database identifiers
- CAS
651316-46-0- PubChem CID
- 10248003
- DTXSID
DTXSID10437323
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 652
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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