3-{[4-(3-chloro-4-methoxyanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol
Chemical Structure Depiction of
3-{[4-(3-chloro-4-methoxyanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol
3-{[4-(3-chloro-4-methoxyanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol
Compound characteristics
| Compound ID: | E781-0252 |
| Compound Name: | 3-{[4-(3-chloro-4-methoxyanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol |
| Molecular Weight: | 362.82 |
| Molecular Formula: | C16 H19 Cl N6 O2 |
| Smiles: | Cn1c2c(cn1)c(Nc1ccc(c(c1)[Cl])OC)nc(NCCCO)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.3523 |
| logD: | 2.3467 |
| logSw: | -3.1336 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.978 |
| InChI Key: | SBZHADPIEZTGRE-UHFFFAOYSA-N |