3-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
3-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0010 |
| Compound Name: | 3-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C23 H21 N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)N1C(=Nc2c3ccccc3sc2C1=O)SCC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5294 |
| logD: | 4.5294 |
| logSw: | -4.1909 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.413 |
| InChI Key: | GZVABQWJXXZKSG-UHFFFAOYSA-N |