4-methylphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Chemical Structure Depiction of
4-methylphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate
4-methylphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Compound characteristics
| Compound ID: | 3909-8251 |
| Compound Name: | 4-methylphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate |
| Molecular Weight: | 354.43 |
| Molecular Formula: | C19 H18 N2 O3 S |
| Smiles: | Cc1ccc(cc1)OC(CN1C=Nc2c(C1=O)c1CCCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5873 |
| logD: | 3.5873 |
| logSw: | -3.9531 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.216 |
| InChI Key: | YUSSGVHKENGHCK-UHFFFAOYSA-N |