N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-3,4-dimethoxybenzamide
N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | F614-0415 |
| Compound Name: | N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 483.53 |
| Molecular Formula: | C26 H25 N7 O3 |
| Smiles: | Cc1cccc(c1C)n1c2c(cn1)c(ncn2)n1c(cc(C)n1)NC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3161 |
| logD: | 4.3128 |
| logSw: | -4.2688 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.701 |
| InChI Key: | JMESPHPZZDMDBC-UHFFFAOYSA-N |