8-(2,3-Difluoro-benzylamino)-1-methyl-1,2,3,4-tetrahydro-pyrimido[1,6-a]pyrimidin-6-one
Basic information
- Standard SMILES
CN1CCCn2c1cc(NCc1cccc(F)c1F)nc2=O- InChIKey
DIXCHXBVMISUAX-UHFFFAOYSA-N- Molecular formula
- C15H16F2N4O
- Average molar mass
- 306.31 g/mol
Names & identifiers
- Preferred name
- 8-(2,3-Difluoro-benzylamino)-1-methyl-1,2,3,4-tetrahydro-pyrimido[1,6-a]pyrimidin-6-one
- IUPAC
- 8-[(2,3-difluorophenyl)methylamino]-1-methyl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one
Names & synonyms
SCHEMBL14656057DIXCHXBVMISUAX-UHFFFAOYSA-N8-(2,3-Difluoro-benzylamino)-1-methyl-1,2,3,4-tetrahydro-pyrimido[1,6-a]pyrimidin-6-one
Database identifiers
- PubChem CID
- 71236554
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 508
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Related reactions
1 records
Compound notes
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