8-[2-(3,4-Dichloro-phenyl)-ethoxy]-1-methyl-1,2,3,4-tetrahydro-pyrimido[1,6-a]pyrimidin-6-one
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Basic information
- Standard SMILES
CN1CCCn2c1cc(OCCc1ccc(Cl)c(Cl)c1)nc2=O- InChIKey
GDLVIAWJPYQPIF-UHFFFAOYSA-N- Molecular formula
- C16H17Cl2N3O2
- Average molar mass
- 354.2 g/mol
- Monoisotopic mass
- 353.0697822
Names & identifiers
- Preferred name
- 8-[2-(3,4-Dichloro-phenyl)-ethoxy]-1-methyl-1,2,3,4-tetrahydro-pyrimido[1,6-a]pyrimidin-6-one
- IUPAC
- 8-[2-(3,4-dichlorophenyl)ethoxy]-1-methyl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one
Names & synonyms
SCHEMBL14656134GDLVIAWJPYQPIF-UHFFFAOYSA-N8-[2-(3,4-Dichloro-phenyl)-ethoxy]-1-methyl-1,2,3,4-tetrahydro-pyrimido[1,6-a]pyrimidin-6-one
Database identifiers
- PubChem CID
- 71236596
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 523
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Related reactions
1 records
Compound notes
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