N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide
Chemical Structure Depiction of
N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide
N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | V026-7083 |
| Compound Name: | N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-4-fluorobenzamide |
| Molecular Weight: | 472.57 |
| Molecular Formula: | C27 H29 F N6 O |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c2c(c(C)n1)c(NC1CCC(CC1)NC(c1ccc(cc1)F)=O)nc(C)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.7628 |
| logD: | 4.4052 |
| logSw: | -4.7844 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.748 |
| InChI Key: | PXVZTBUETORZLF-UHFFFAOYSA-N |