Basic information
- Standard SMILES
O=C1CNc2ncc(Br)nc2N1CC1CCOCC1- InChIKey
DYWQEAIELCVSMZ-UHFFFAOYSA-N- Molecular formula
- C12H15BrN4O2
- Average molar mass
- 327.18 g/mol
Names & identifiers
- Preferred name
- 7-bromo-1-((tetrahydro-2H-pyran-4-yl)methyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
- IUPAC
- 3-bromo-5-(oxan-4-ylmethyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
Names & synonyms
SCHEMBL151688DYWQEAIELCVSMZ-UHFFFAOYSA-N7-bromo-1-((tetrahydro-2H-pyran-4-yl)methyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
Database identifiers
- PubChem CID
- 86644642
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 338
Related reactions
14 records
Compound notes
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