N~4~-(3-chloro-4-methylphenyl)-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Chemical Structure Depiction of
N~4~-(3-chloro-4-methylphenyl)-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
N~4~-(3-chloro-4-methylphenyl)-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | E781-0198 |
| Compound Name: | N~4~-(3-chloro-4-methylphenyl)-1-methyl-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine |
| Molecular Weight: | 328.8 |
| Molecular Formula: | C16 H17 Cl N6 |
| Smiles: | Cc1ccc(cc1[Cl])Nc1c2cnn(C)c2nc(NCC=C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3809 |
| logD: | 4.3765 |
| logSw: | -4.3889 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.692 |
| InChI Key: | VOGSOBRILXLOCJ-UHFFFAOYSA-N |