Basic information
- Standard SMILES
O=c1cc(-c2ccncn2)nc2n1CC(F)(F)CN2- InChIKey
FRCYVTKSFMRYAS-UHFFFAOYSA-N- Molecular formula
- C11H9F2N5O
- Average molar mass
- 265.22 g/mol
Names & identifiers
- Preferred name
- 7,7-Difluoro-2-(pyrimidin-4-yl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-one
- IUPAC
- 7,7-difluoro-2-pyrimidin-4-yl-8,9-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one
Names & synonyms
7,7-Difluoro-2-(pyrimidin-4-yl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-oneSCHEMBL3568346
Database identifiers
- PubChem CID
- 136334119
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 462
Related reactions
2 records
Compound notes
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