diethyl 5-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)oxy]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
diethyl 5-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)oxy]benzene-1,3-dicarboxylate
diethyl 5-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)oxy]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 3993-2591 |
| Compound Name: | diethyl 5-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)oxy]benzene-1,3-dicarboxylate |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C22 H22 N2 O5 S |
| Smiles: | CCOC(c1cc(cc(c1)Oc1c2c3CCCCc3sc2ncn1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.629 |
| logD: | 5.629 |
| logSw: | -5.5758 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.086 |
| InChI Key: | MQGOYUQQJIMZEN-UHFFFAOYSA-N |