N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-methoxybenzamide
N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | V025-0701 |
| Compound Name: | N-(2-{[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-4-methoxybenzamide |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C24 H25 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | CC(C)c1nc(c2cnn(c3ccccc3[Cl])c2n1)NCCNC(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5171 |
| logD: | 4.4969 |
| logSw: | -4.5101 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.722 |
| InChI Key: | ISCMSHMXTABFNS-UHFFFAOYSA-N |