9,10-dimethoxy-2-[(4-methylphenyl)sulfanyl]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Chemical Structure Depiction of
9,10-dimethoxy-2-[(4-methylphenyl)sulfanyl]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
9,10-dimethoxy-2-[(4-methylphenyl)sulfanyl]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Compound characteristics
| Compound ID: | 8018-2422 |
| Compound Name: | 9,10-dimethoxy-2-[(4-methylphenyl)sulfanyl]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C21 H20 N2 O3 S |
| Smiles: | Cc1ccc(cc1)SC1C=C2c3cc(c(cc3CCN2C(N=1)=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.6294 |
| logD: | 4.6294 |
| logSw: | -4.3837 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.099 |
| InChI Key: | XTZPKELLEYHJMF-UHFFFAOYSA-N |