N-(4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-N'-ethylurea
Chemical Structure Depiction of
N-(4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-N'-ethylurea
N-(4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-N'-ethylurea
Compound characteristics
| Compound ID: | V024-9956 |
| Compound Name: | N-(4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-N'-ethylurea |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C23 H31 N7 O |
| Smiles: | CCNC(NC1CCC(CC1)Nc1c2c(C)nn(c3ccc(C)cc3)c2nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4786 |
| logD: | 3.3895 |
| logSw: | -3.8104 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.18 |
| InChI Key: | PVXTVZAJTYOLMA-UHFFFAOYSA-N |