N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-fluorobenzamide
N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | V027-8219 |
| Compound Name: | N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-fluorobenzamide |
| Molecular Weight: | 507.01 |
| Molecular Formula: | C27 H28 Cl F N6 O |
| Salt: | not_available |
| Smiles: | Cc1c2c(NCCNC(c3ccc(cc3)F)=O)nc(C3CCCCC3)nc2n(c2cccc(c2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6815 |
| logD: | 5.4069 |
| logSw: | -6.0036 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.752 |
| InChI Key: | CWUGDRUWNNSKLI-UHFFFAOYSA-N |