2-(benzylsulfanyl)-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}acetamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}acetamide
2-(benzylsulfanyl)-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}acetamide
Compound characteristics
| Compound ID: | F614-0354 |
| Compound Name: | 2-(benzylsulfanyl)-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}acetamide |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C24 H20 F N7 O S |
| Smiles: | Cc1cc(NC(CSCc2ccccc2)=O)n(c2c3cnn(c4ccc(cc4)F)c3ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2582 |
| logD: | 4.2541 |
| logSw: | -4.1138 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.527 |
| InChI Key: | OKFLCWNBRLFHNY-UHFFFAOYSA-N |