N-{1-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2,6-difluorobenzamide
Chemical Structure Depiction of
N-{1-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2,6-difluorobenzamide
N-{1-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2,6-difluorobenzamide
Compound characteristics
| Compound ID: | F614-0237 |
| Compound Name: | N-{1-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2,6-difluorobenzamide |
| Molecular Weight: | 465.85 |
| Molecular Formula: | C22 H14 Cl F2 N7 O |
| Smiles: | Cc1cc(NC(c2c(cccc2F)F)=O)n(c2c3cnn(c4cccc(c4)[Cl])c3ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7259 |
| logD: | 4.1596 |
| logSw: | -5.1684 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.741 |
| InChI Key: | IDSVZIWVHHNSJA-UHFFFAOYSA-N |