5-{[2-(2,4-difluorophenyl)-2-oxoethyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
5-{[2-(2,4-difluorophenyl)-2-oxoethyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
5-{[2-(2,4-difluorophenyl)-2-oxoethyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | Y502-5247 |
| Compound Name: | 5-{[2-(2,4-difluorophenyl)-2-oxoethyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 378.4 |
| Molecular Formula: | C17 H16 F2 N4 O2 S |
| Smiles: | CCN1C(=Nc2cn(CC)nc2C1=O)SCC(c1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.44 |
| logD: | 2.44 |
| logSw: | -2.7471 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.153 |
| InChI Key: | UBFCXSRULXYZQO-UHFFFAOYSA-N |