ethyl 4-[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate
ethyl 4-[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | K292-1785 |
| Compound Name: | ethyl 4-[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]piperidine-1-carboxylate |
| Molecular Weight: | 452.59 |
| Molecular Formula: | C20 H28 N4 O4 S2 |
| Smiles: | CCCCNC(CSC1=Nc2ccsc2C(N1C1CCN(CC1)C(=O)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1024 |
| logD: | 3.1024 |
| logSw: | -3.2811 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.376 |
| InChI Key: | RJXPJBVCZWZOLU-UHFFFAOYSA-N |