2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0701 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 454.54 |
| Molecular Formula: | C23 H19 F N2 O3 S2 |
| Smiles: | C1CC(CN2C(=Nc3c4ccccc4sc3C2=O)SCC(c2ccc(cc2)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1368 |
| logD: | 4.1368 |
| logSw: | -4.3928 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.167 |
| InChI Key: | LTNHLLTYZVOBLU-MRXNPFEDSA-N |