1-[5-(4-ethylpiperazin-1-yl)-2-fluoro-4-nitrophenyl]azepane
Chemical Structure Depiction of
1-[5-(4-ethylpiperazin-1-yl)-2-fluoro-4-nitrophenyl]azepane
1-[5-(4-ethylpiperazin-1-yl)-2-fluoro-4-nitrophenyl]azepane
Compound characteristics
| Compound ID: | 6485-2824 |
| Compound Name: | 1-[5-(4-ethylpiperazin-1-yl)-2-fluoro-4-nitrophenyl]azepane |
| Molecular Weight: | 350.43 |
| Molecular Formula: | C18 H27 F N4 O2 |
| Smiles: | CCN1CCN(CC1)c1cc(c(cc1[N+]([O-])=O)F)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6681 |
| logD: | 3.1018 |
| logSw: | -3.976 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.49 |
| InChI Key: | QSUKZBUCLHGIHZ-UHFFFAOYSA-N |