2-{4-[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}ethan-1-ol
Chemical Structure Depiction of
2-{4-[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}ethan-1-ol
2-{4-[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}ethan-1-ol
Compound characteristics
| Compound ID: | E781-0334 |
| Compound Name: | 2-{4-[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}ethan-1-ol |
| Molecular Weight: | 401.9 |
| Molecular Formula: | C19 H24 Cl N7 O |
| Smiles: | Cc1cc(ccc1Nc1c2cnn(C)c2nc(n1)N1CCN(CC1)CCO)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.429 |
| logD: | 3.2664 |
| logSw: | -3.5001 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.338 |
| InChI Key: | QUBACAFWBVYYHO-UHFFFAOYSA-N |