2-chloro-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-6-fluorobenzamide
Chemical Structure Depiction of
2-chloro-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-6-fluorobenzamide
2-chloro-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-6-fluorobenzamide
Compound characteristics
| Compound ID: | F614-0523 |
| Compound Name: | 2-chloro-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-6-fluorobenzamide |
| Molecular Weight: | 475.91 |
| Molecular Formula: | C24 H19 Cl F N7 O |
| Smiles: | Cc1ccc(c(C)c1)n1c2c(cn1)c(ncn2)n1c(cc(C)n1)NC(c1c(cccc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4806 |
| logD: | 4.9143 |
| logSw: | -6.2913 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.44 |
| InChI Key: | XABUMQGFJNQLFQ-UHFFFAOYSA-N |