3-{[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol
Chemical Structure Depiction of
3-{[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol
3-{[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol
Compound characteristics
| Compound ID: | E781-0309 |
| Compound Name: | 3-{[4-(4-chloro-2-methylanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol |
| Molecular Weight: | 346.82 |
| Molecular Formula: | C16 H19 Cl N6 O |
| Smiles: | Cc1cc(ccc1Nc1c2cnn(C)c2nc(NCCCO)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0192 |
| logD: | 3.0136 |
| logSw: | -3.1898 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.65 |
| InChI Key: | PAVDQTMKCQVQLR-UHFFFAOYSA-N |