4-butoxyphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Chemical Structure Depiction of
4-butoxyphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate
4-butoxyphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Compound characteristics
| Compound ID: | 3909-8270 |
| Compound Name: | 4-butoxyphenyl (4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C22 H24 N2 O4 S |
| Smiles: | CCCCOc1ccc(cc1)OC(CN1C=Nc2c(C1=O)c1CCCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5962 |
| logD: | 4.5962 |
| logSw: | -4.4869 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.634 |
| InChI Key: | TYBGXLLOFFDCKL-UHFFFAOYSA-N |