Basic information
- CAS
16290-56-5- Standard SMILES
O=c1[nH]c(-c2ccccc2)c(Br)c(=O)[nH]1- InChIKey
GRHCUTUQPABERT-UHFFFAOYSA-N- Molecular formula
- C10H7BrN2O2
- Average molar mass
- 267.08 g/mol
- Monoisotopic mass
- 265.96909
Names & identifiers
- Preferred name
- 5-bromo-6-phenyl-1H-pyrimidine-2,4-dione
- IUPAC
- 5-bromo-6-phenyl-1H-pyrimidine-2,4-dione
Names & synonyms
NSC21223016290-56-5CHEMBL36261SCHEMBL14290780DTXSID403095245-Brom-4-hydroxy-6-phenylpyrimidinonNSC-2122305-Bromo-6-phenylpyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
16290-56-5- PubChem CID
- 309796
- DTXSID
DTXSID40309524- ChEMBL
CHEMBL36261
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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