Basic information
- Standard SMILES
COc1cc(C=Cc2nc3c(C)cccn3c(=O)c2C)cc(OC)c1OC- InChIKey
JROPBGGSGAKONR-UHFFFAOYSA-N- Molecular formula
- C21H22N2O4
- Average molar mass
- 366.4 g/mol
Names & identifiers
- Preferred name
- 3,9-Dimethyl-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]pyrido[1,2-a]pyrimidin-4-one
- IUPAC
- 3,9-dimethyl-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]pyrido[1,2-a]pyrimidin-4-one
Names & synonyms
SCHEMBL11808254
Database identifiers
- PubChem CID
- 56608007
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 733
Related reactions
1 records
Linked notes
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