ethyl {[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
ethyl {[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 4469-0551 |
| Compound Name: | ethyl {[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 364.48 |
| Molecular Formula: | C17 H20 N2 O3 S2 |
| Smiles: | CCOC(CSC1=Nc2c(C(N1CC=C)=O)c1CCCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5908 |
| logD: | 3.5908 |
| logSw: | -3.8463 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.274 |
| InChI Key: | CPQFLKLKKYUQHA-UHFFFAOYSA-N |