ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate
ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | K292-1724 |
| Compound Name: | ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate |
| Molecular Weight: | 532.64 |
| Molecular Formula: | C24 H28 N4 O6 S2 |
| Smiles: | CCOC(N1CCC(CC1)N1C(=Nc2ccsc2C1=O)SCC(Nc1ccc(cc1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5126 |
| logD: | 3.5126 |
| logSw: | -3.8553 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.417 |
| InChI Key: | ZGYXMWNACDPRDM-UHFFFAOYSA-N |