2(1H)-Pyrimidinone, 6-amino-5-bromo-1-methyl-
Basic information
- CAS
36323-98-5- Standard SMILES
Cn1c(N)c(Br)cnc1=O- InChIKey
XACAVKRIWZBIHT-UHFFFAOYSA-N- Molecular formula
- C5H6BrN3O
- Average molar mass
- 204.02 g/mol
- Monoisotopic mass
- 202.96942
Names & identifiers
- Preferred name
- 2(1H)-Pyrimidinone, 6-amino-5-bromo-1-methyl-
- IUPAC
- 6-amino-5-bromo-1-methylpyrimidin-2-one
Names & synonyms
2(1H)-Pyrimidinone, 6-amino-5-bromo-1-methyl-36323-98-56-Amino-5-bromo-1-methyl-2(1H)-pyrimidinoneDTXSID601898606-amino-5-bromo-1-methylpyrimidin-2(1H)-one
Database identifiers
- CAS
36323-98-5- PubChem CID
- 150778
- DTXSID
DTXSID60189860
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 233
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Compound notes
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