6-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
6-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
6-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C365-0203 |
| Compound Name: | 6-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C21 H25 N5 O2 S |
| Smiles: | CCC1CCCCN1C(CSC1NC(c2cnn(c3ccc(C)cc3)c2N=1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5273 |
| logD: | 3.4643 |
| logSw: | -3.5737 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.49 |
| InChI Key: | FKYWOIWVTQIBQX-HNNXBMFYSA-N |