2-{4-[2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-ol
Chemical Structure Depiction of
2-{4-[2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-ol
2-{4-[2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-ol
Compound characteristics
| Compound ID: | 2023-0266 |
| Compound Name: | 2-{4-[2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-ol |
| Molecular Weight: | 320.39 |
| Molecular Formula: | C16 H24 N4 O3 |
| Smiles: | C1CCN(C1)c1ccc(c(c1)N1CCN(CC1)CCO)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1182 |
| logD: | 2 |
| logSw: | -2.4104 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.735 |
| InChI Key: | PDSYPHRKXKDOAH-UHFFFAOYSA-N |