2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0445 |
| Compound Name: | 2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 491.67 |
| Molecular Formula: | C27 H29 N3 O2 S2 |
| Smiles: | CCC1CCCCN1C(CSC1=Nc2c3ccccc3sc2C(N1CCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6311 |
| logD: | 5.6311 |
| logSw: | -5.5589 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.283 |
| InChI Key: | HXLAFQUISYKMDU-FQEVSTJZSA-N |