ethyl {[3-(4-methylphenyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[3-(4-methylphenyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate
ethyl {[3-(4-methylphenyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | K263-0018 |
| Compound Name: | ethyl {[3-(4-methylphenyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 410.51 |
| Molecular Formula: | C21 H18 N2 O3 S2 |
| Smiles: | CCOC(CSC1=Nc2c3ccccc3sc2C(N1c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6966 |
| logD: | 4.6966 |
| logSw: | -4.4104 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.085 |
| InChI Key: | CSSOFUPGKXNLDS-UHFFFAOYSA-N |