Basic information
- CAS
21271-27-2- Standard SMILES
Br.CC(COc1nc2cnccn2c(=O)c1-c1ccccc1)CN(C)C- InChIKey
JOVVFEIAACTDLQ-UHFFFAOYSA-N- Molecular formula
- C19H23BrN4O2
- Average molar mass
- 419.3 g/mol
- Monoisotopic mass
- 418.10044
Names & identifiers
- Preferred name
- 4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-(3-(dimethylamino)-2-methylpropoxy)-3-phenyl-, hydrobromide
- IUPAC
- 2-[3-(dimethylamino)-2-methylpropoxy]-3-phenylpyrazino[1,2-a]pyrimidin-4-one;hydrobromide
Names & synonyms
4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-(3-(dimethylamino)-2-methylpropoxy)-3-phenyl-, hydrobromide21271-27-2RefChem:297679DTXSID70943758AKOS0302543592-[3-(Dimethylamino)-2-methylpropoxy]-3-phenyl-4H-pyrazino[1,2-a]pyrimidin-4-one--hydrogen bromide (1/1)
Database identifiers
- CAS
21271-27-2- PubChem CID
- 89475
- DTXSID
DTXSID70943758
Properties
Computed structural properties
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 627
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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