pentyl 4-{[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]oxy}benzoate
Chemical Structure Depiction of
pentyl 4-{[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]oxy}benzoate
pentyl 4-{[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]oxy}benzoate
Compound characteristics
| Compound ID: | 3909-8334 |
| Compound Name: | pentyl 4-{[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]oxy}benzoate |
| Molecular Weight: | 454.54 |
| Molecular Formula: | C24 H26 N2 O5 S |
| Smiles: | CCCCCOC(c1ccc(cc1)OC(CN1C=Nc2c(C1=O)c1CCCCc1s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3001 |
| logD: | 5.3001 |
| logSw: | -5.2159 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.264 |
| InChI Key: | OONFCBNJSFHGOE-UHFFFAOYSA-N |