N~4~-[(2-chlorophenyl)methyl]-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N~4~-[(2-chlorophenyl)methyl]-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine--hydrogen chloride (1/1)
N~4~-[(2-chlorophenyl)methyl]-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | G414-0572 |
| Compound Name: | N~4~-[(2-chlorophenyl)methyl]-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine--hydrogen chloride (1/1) |
| Molecular Weight: | 365.26 |
| Molecular Formula: | C16 H17 Cl N6 |
| Salt: | HCl |
| Smiles: | Cn1c2c(cn1)c(NCc1ccccc1[Cl])nc(NCC=C)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.3424 |
| logD: | 3.3158 |
| logSw: | -3.5619 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.014 |
| InChI Key: | FJBYWJSMEHPLLD-UHFFFAOYSA-N |