2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(pyridin-3-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(pyridin-3-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(pyridin-3-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0774 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(pyridin-3-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C24 H16 F N3 O2 S2 |
| Smiles: | C(c1cccnc1)N1C(=Nc2c3ccccc3sc2C1=O)SCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3809 |
| logD: | 4.3809 |
| logSw: | -4.3839 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.031 |
| InChI Key: | CLVRRRUATNYVEI-UHFFFAOYSA-N |