4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-(2-diethylaminoethoxy)-3-phenyl-, hydrobromide
Basic information
- CAS
21271-20-5- Standard SMILES
Br.CCN(CC)CCOc1nc2cnccn2c(=O)c1-c1ccccc1- InChIKey
MRNBOUPAFLSVJI-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-(2-diethylaminoethoxy)-3-phenyl-, hydrobromide
- IUPAC
- 2-[2-(diethylamino)ethoxy]-3-phenylpyrazino[1,2-a]pyrimidin-4-one;hydrobromide
Names & synonyms
4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-(2-diethylaminoethoxy)-3-phenyl-, hydrobromideDTXSID201755222-(2-Diethylaminoethoxy)-3-phenyl-4H-pyrazino(1,2-a)pyrimidin-4-one hydrobromide21271-20-5RefChem:297676DTXCID40980132-[2-(Diethylamino)ethoxy]-3-phenyl-4H-pyrazino[1,2-a]pyrimidin-4-one--hydrogen bromide (1/1)
Database identifiers
- CAS
21271-20-5- PubChem CID
- 88845
- DTXSID
DTXSID20175522
Properties
Computed structural properties
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 611
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Compound notes
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