Basic information
- Standard SMILES
O=C1NC(=O)C(O)(c2c[nH]c3ccc(Br)cc23)C(=O)N1- InChIKey
GQQGPPYEEUQCTR-UHFFFAOYSA-N- Molecular formula
- C12H8BrN3O4
- Average molar mass
- 338.11 g/mol
Names & identifiers
- Preferred name
- 5-Hydroxy-5-(5-bromo-3-indolyl)-2,4,6-(1H,3H,5H)pyrimidinetrione
- IUPAC
- 5-(5-bromo-1H-indol-3-yl)-5-hydroxy-1,3-diazinane-2,4,6-trione
Names & synonyms
SCHEMBL10548539GQQGPPYEEUQCTR-UHFFFAOYSA-N5-Hydroxy-5-(5-bromo-3-indolyl)-2,4,6- (1H,3H,5H)pyrimidinetrione5-Hydroxy-5-(5-bromo-3-indolyl)-2,4,6-(1H,3H,5H)pyrimidinetrione
Database identifiers
- PubChem CID
- 13282895
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 463
Related reactions
7 records
Linked notes
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