6-(benzenesulfonyl)-1H-pyrimidine-2,4-dione
Basic information
- CAS
19188-52-4- Standard SMILES
O=c1cc(S(=O)(=O)c2ccccc2)[nH]c(=O)[nH]1- InChIKey
TUUDBDVTFLNOJM-UHFFFAOYSA-N- Molecular formula
- C10H8N2O4S
- Average molar mass
- 252.25 g/mol
- Monoisotopic mass
- 252.02047791
Names & identifiers
- Preferred name
- 6-(benzenesulfonyl)-1H-pyrimidine-2,4-dione
- IUPAC
- 6-(benzenesulfonyl)-1H-pyrimidine-2,4-dione
Names & synonyms
NSC21240819188-52-4DTXSID40309625NSC-2124086-(Benzenesulfonyl)pyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
19188-52-4- PubChem CID
- 309947
- DTXSID
DTXSID40309625
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 469
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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