N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide
Chemical Structure Depiction of
N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide
N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V005-5809 |
| Compound Name: | N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-methylbutanamide |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C21 H28 N6 O |
| Salt: | not_available |
| Smiles: | CC(C)CC(NCCNc1c2c(C)nn(c3cccc(C)c3)c2nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0613 |
| logD: | 2.6116 |
| logSw: | -3.3624 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.503 |
| InChI Key: | XBRUXCCWJXAUHV-UHFFFAOYSA-N |