N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide
Chemical Structure Depiction of
N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide
N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V019-0974 |
| Compound Name: | N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide |
| Molecular Weight: | 469.03 |
| Molecular Formula: | C25 H33 Cl N6 O |
| Salt: | not_available |
| Smiles: | CC(C)CC(NCCNc1c2c(C)nn(c3cccc(c3)[Cl])c2nc(C2CCCCC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2416 |
| logD: | 4.967 |
| logSw: | -5.6499 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.811 |
| InChI Key: | VOBUWRYVDGQJLT-UHFFFAOYSA-N |