6-ethyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-ethyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
6-ethyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4408-0035 |
| Compound Name: | 6-ethyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 388.48 |
| Molecular Formula: | C19 H17 F N2 O2 S2 |
| Smiles: | CCc1cc2C(N(CC=C)C(=Nc2s1)SCC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2906 |
| logD: | 4.2906 |
| logSw: | -4.3244 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.17 |
| InChI Key: | QLVHBFCMSCXAME-UHFFFAOYSA-N |