1-methyl-N~4~-(4-methylphenyl)-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Chemical Structure Depiction of
1-methyl-N~4~-(4-methylphenyl)-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
1-methyl-N~4~-(4-methylphenyl)-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | E781-0597 |
| Compound Name: | 1-methyl-N~4~-(4-methylphenyl)-N~6~-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine |
| Molecular Weight: | 294.36 |
| Molecular Formula: | C16 H18 N6 |
| Smiles: | Cc1ccc(cc1)Nc1c2cnn(C)c2nc(NCC=C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.414 |
| logD: | 3.4096 |
| logSw: | -3.4542 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.692 |
| InChI Key: | VPPSQUVPWWXVQI-UHFFFAOYSA-N |