5-Bromo-5,6-dihydrouracil
Basic information
- CAS
1193-76-6- Standard SMILES
O=C1NCC(Br)C(=O)N1- InChIKey
ZCDARRSUPCSLRW-UHFFFAOYSA-N- Molecular formula
- C4H5BrN2O2
- Average molar mass
- 193 g/mol
- Monoisotopic mass
- 191.95344
Overview
structure given in first source
Names & identifiers
- Preferred name
- 5-Bromo-5,6-dihydrouracil
- IUPAC
- 5-bromo-1,3-diazinane-2,4-dione
- English name
- 5-bromodihydro-24(1h3h)-pyrimidinedione
- Molecular formula
- C4H5BrN2O2
- Molecular weight
- 193
Names & synonyms
1193-76-65-Bromo-5,6-dihydrouracilBrH2U2,4(1H,3H)-Pyrimidinedione, 5-bromodihydro-RefChem:102177Hydrouracil, 5-bromo-5-bromo-1,3-diazinane-2,4-dione5-bromodihydrouracil5-bromodihydropyrimidine-2,4(1h,3h)-dione5-bromodihydro-24(1h3h)-pyrimidinedione5-Bromodihydro-2,4(1H,3H)-pyrimidinedioneNSC 44132
Show more names
AI3-50445SCHEMBL16349234DTXSID601365360NSC44132NSC-441325-bromohexahydropyrimidine-2,4-dioneAKOS001170836CS-0239736
Database identifiers
- CAS
1193-76-6- PubChem CID
- 97819
- DTXSID
DTXSID601365360- EC Number
- 884-510-6
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 159
Chemistry & industry
Applications
Uses5-Bromodihydrouracil is predominantly used as a research agent for dihydropyrimidinase and dihydropyrimidine dehydrogenase.
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Related reactions
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Compound notes
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