3-[2-(4-chlorophenyl)ethyl]-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)ethyl]-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-[2-(4-chlorophenyl)ethyl]-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-0176 |
| Compound Name: | 3-[2-(4-chlorophenyl)ethyl]-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 462.03 |
| Molecular Formula: | C22 H24 Cl N3 O2 S2 |
| Smiles: | CC1CCN(CC1)C(CSC1=Nc2ccsc2C(N1CCc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6737 |
| logD: | 4.6737 |
| logSw: | -4.7321 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.16 |
| InChI Key: | VPHSNBIESJYUPI-UHFFFAOYSA-N |