1-(3-methylphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
1-(3-methylphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
1-(3-methylphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | K402-0694 |
| Compound Name: | 1-(3-methylphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 415.45 |
| Molecular Formula: | C22 H21 N7 O2 |
| Smiles: | Cc1cccc(c1)n1c2c(cn1)c(ncn2)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9343 |
| logD: | 4.9265 |
| logSw: | -4.6901 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.503 |
| InChI Key: | DWYVBLXENFKVOW-UHFFFAOYSA-N |