6-(4-Bromo-phenylamino)-1H-pyrimidine-2,4-dione
Basic information
- CAS
21333-03-9- Standard SMILES
O=c1cc(Nc2ccc(Br)cc2)[nH]c(=O)[nH]1- InChIKey
KVJLEUZMCGNFGQ-UHFFFAOYSA-N- Molecular formula
- C10H8BrN3O2
- Average molar mass
- 282.09 g/mol
- Monoisotopic mass
- 280.97999
Names & identifiers
- Preferred name
- 6-(4-Bromo-phenylamino)-1H-pyrimidine-2,4-dione
- IUPAC
- 6-(4-bromoanilino)-1H-pyrimidine-2,4-dione
Names & synonyms
21333-03-96-(4-Bromo-phenylamino)-1H-pyrimidine-2,4-dioneRefChem:306597CHEMBL293964NSC-212333NSC2123332,4(1H,3H)-Pyrimidinedione, 6-[(4-bromophenyl)amino]-6-(4-bromoanilino)-1H-pyrimidine-2,4-dioneCambridge id 5630405HW74AL49WSOprea1_666298Oprea1_831727
Show more names
Uracil, 6-(p-bromoanilino)-DTXSID70309572BDBM50028349AKOS000541604PD182725AB00091234-016-(4-bromoanilino)-2,4(1H,3H)-pyrimidinedione6-(4-Bromoanilino)pyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
21333-03-9- PubChem CID
- 309876
- DTXSID
DTXSID70309572- ChEMBL
CHEMBL293964- UNII
- HW74AL49WS
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 335
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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