ethyl 4-[2-(2,4-dioxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(2,4-dioxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
ethyl 4-[2-(2,4-dioxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | C258-0637 |
| Compound Name: | ethyl 4-[2-(2,4-dioxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate |
| Molecular Weight: | 503.58 |
| Molecular Formula: | C27 H25 N3 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(N(C(c2c3CCCCc3sc12)=O)c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9424 |
| logD: | 4.9424 |
| logSw: | -4.6437 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.931 |
| InChI Key: | GRWVVYPALZKVAB-UHFFFAOYSA-N |