2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4469-0541 |
| Compound Name: | 2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C22 H18 N2 O2 S3 |
| Smiles: | C1CCc2c(C1)c1C(N(C(=Nc1s2)SCC(c1cccs1)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0305 |
| logD: | 5.0305 |
| logSw: | -4.9805 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.248 |
| InChI Key: | XGFQWEITNXPPPQ-UHFFFAOYSA-N |