3-[(4-{[(4-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]propan-1-ol--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[(4-{[(4-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]propan-1-ol--hydrogen chloride (1/1)
3-[(4-{[(4-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]propan-1-ol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | G414-0626 |
| Compound Name: | 3-[(4-{[(4-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]propan-1-ol--hydrogen chloride (1/1) |
| Molecular Weight: | 383.28 |
| Molecular Formula: | C16 H19 Cl N6 O |
| Salt: | HCl |
| Smiles: | Cn1c2c(cn1)c(NCc1ccc(cc1)[Cl])nc(NCCCO)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.0061 |
| logD: | 1.9725 |
| logSw: | -2.3281 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.67 |
| InChI Key: | XWOXIMBCMAAVRK-UHFFFAOYSA-N |