N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-4-methylbenzamide
N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V026-2186 |
| Compound Name: | N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-4-methylbenzamide |
| Molecular Weight: | 400.48 |
| Molecular Formula: | C23 H24 N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(NCCNc1c2c(C)nn(c3ccccc3)c2nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2806 |
| logD: | 3.1589 |
| logSw: | -3.7032 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.445 |
| InChI Key: | CNNPYLBESGQSKC-UHFFFAOYSA-N |