N-(4-{[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(4-{[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-(trifluoromethyl)benzamide
N-(4-{[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V028-2351 |
| Compound Name: | N-(4-{[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 536.6 |
| Molecular Formula: | C29 H31 F3 N6 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccc(C)cc3)c2n1)NC1CCC(CC1)NC(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0195 |
| logD: | 5.9097 |
| logSw: | -5.8602 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.126 |
| InChI Key: | DHNJQKQIYQCYCP-UHFFFAOYSA-N |