5-{[(3-chlorophenyl)methyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
5-{[(3-chlorophenyl)methyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
5-{[(3-chlorophenyl)methyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | Y502-5239 |
| Compound Name: | 5-{[(3-chlorophenyl)methyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 348.85 |
| Molecular Formula: | C16 H17 Cl N4 O S |
| Smiles: | CCN1C(=Nc2cn(CC)nc2C1=O)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1101 |
| logD: | 3.11 |
| logSw: | -3.3261 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.907 |
| InChI Key: | CJNHLTUOTSCRRE-UHFFFAOYSA-N |