N-(4-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide
Chemical Structure Depiction of
N-(4-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide
N-(4-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | V024-5826 |
| Compound Name: | N-(4-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C28 H31 F N6 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccccc3C)c2n1)NC1CCC(CC1)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1372 |
| logD: | 4.8771 |
| logSw: | -5.1394 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.825 |
| InChI Key: | XLWHGXVBHBYNPO-UHFFFAOYSA-N |