N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)thiophene-2-carboxamide
N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V025-0678 |
| Compound Name: | N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)thiophene-2-carboxamide |
| Molecular Weight: | 440.95 |
| Molecular Formula: | C21 H21 Cl N6 O S |
| Salt: | not_available |
| Smiles: | CC(C)c1nc(c2cnn(c3ccccc3[Cl])c2n1)NCCNC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3696 |
| logD: | 4.3494 |
| logSw: | -4.2651 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.196 |
| InChI Key: | WLEUSVBMYSEPIX-UHFFFAOYSA-N |