N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-cyclohexylacetamide
Chemical Structure Depiction of
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-cyclohexylacetamide
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-cyclohexylacetamide
Compound characteristics
| Compound ID: | F614-0108 |
| Compound Name: | N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-cyclohexylacetamide |
| Molecular Weight: | 449.94 |
| Molecular Formula: | C23 H24 Cl N7 O |
| Smiles: | Cc1cc(NC(CC2CCCCC2)=O)n(c2c3cnn(c4ccc(cc4)[Cl])c3ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0749 |
| logD: | 5.0733 |
| logSw: | -5.2034 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.72 |
| InChI Key: | BGWZVSOEQJKBOJ-UHFFFAOYSA-N |