2-{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}ethan-1-ol
Chemical Structure Depiction of
2-{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}ethan-1-ol
2-{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}ethan-1-ol
Compound characteristics
| Compound ID: | 8013-6738 |
| Compound Name: | 2-{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}ethan-1-ol |
| Molecular Weight: | 345.4 |
| Molecular Formula: | C17 H23 N5 O3 |
| Smiles: | Cc1cc(C)n(c2cc(ccc2[N+]([O-])=O)N2CCN(CC2)CCO)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.2372 |
| logD: | 1.0762 |
| logSw: | -1.874 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.788 |
| InChI Key: | NFOIEBYDUSUMEI-UHFFFAOYSA-N |