6-[(butan-2-yl)sulfanyl]-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
6-[(butan-2-yl)sulfanyl]-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
6-[(butan-2-yl)sulfanyl]-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C099-0305 |
| Compound Name: | 6-[(butan-2-yl)sulfanyl]-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C15 H15 F N4 O S |
| Smiles: | CCC(C)SC1NC(c2cnn(c3ccc(cc3)F)c2N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6174 |
| logD: | 3.593 |
| logSw: | -3.7488 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.723 |
| InChI Key: | AWVMXECQNDXIGY-VIFPVBQESA-N |