Basic information
- Standard SMILES
COc1ccc2c(c1)CCn1c-2cc(Nc2c(C)cccc2O)nc1=O- InChIKey
UISGPUSUIWIOMP-UHFFFAOYSA-N- Molecular formula
- C20H19N3O3
- Average molar mass
- 349.4 g/mol
Names & identifiers
- Preferred name
- 2-(2-Hydroxy-6-methyl-phenylamino)-9-methoxy-6,7-dihydro-pyrimido[6,1-a]isoquinolin-4-one
- IUPAC
- 2-(2-hydroxy-6-methylanilino)-9-methoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Names & synonyms
SCHEMBL4459131UISGPUSUIWIOMP-UHFFFAOYSA-N2-(2-Hydroxy-6-methyl-phenylamino)-9-methoxy-6,7-dihydro-pyrimido[6,1-a]isoquinolin-4-one
Database identifiers
- PubChem CID
- 57591097
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 617
Related reactions
2 records
Compound notes
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