N~4~-(2H-1,3-benzodioxol-5-yl)-N~6~-cycloheptyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Chemical Structure Depiction of
N~4~-(2H-1,3-benzodioxol-5-yl)-N~6~-cycloheptyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
N~4~-(2H-1,3-benzodioxol-5-yl)-N~6~-cycloheptyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | G932-0837 |
| Compound Name: | N~4~-(2H-1,3-benzodioxol-5-yl)-N~6~-cycloheptyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine |
| Molecular Weight: | 442.52 |
| Molecular Formula: | C25 H26 N6 O2 |
| Smiles: | C1CCCC(CC1)Nc1nc(c2cnn(c3ccccc3)c2n1)Nc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 6.4222 |
| logD: | 6.4209 |
| logSw: | -6.1023 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.329 |
| InChI Key: | RJFIRKQJHRXHSI-UHFFFAOYSA-N |