N-tert-butyl-N'-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea
Chemical Structure Depiction of
N-tert-butyl-N'-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea
N-tert-butyl-N'-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea
Compound characteristics
| Compound ID: | V019-1690 |
| Compound Name: | N-tert-butyl-N'-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea |
| Molecular Weight: | 429.95 |
| Molecular Formula: | C21 H28 Cl N7 O |
| Salt: | not_available |
| Smiles: | CC(C)c1nc(c2cnn(c3ccccc3[Cl])c2n1)NCCNC(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3667 |
| logD: | 4.3465 |
| logSw: | -4.2951 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.807 |
| InChI Key: | GDQBLZFDZXCHED-UHFFFAOYSA-N |