5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitro-N-(2-phenoxyethyl)aniline
Chemical Structure Depiction of
5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitro-N-(2-phenoxyethyl)aniline
5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitro-N-(2-phenoxyethyl)aniline
Compound characteristics
| Compound ID: | 3819-1341 |
| Compound Name: | 5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitro-N-(2-phenoxyethyl)aniline |
| Molecular Weight: | 496.58 |
| Molecular Formula: | C25 H28 N4 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)c1ccc(c(c1)NCCOc1ccccc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2241 |
| logD: | 5.2241 |
| logSw: | -5.1254 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.086 |
| InChI Key: | BCNAGKLUPRYTQR-UHFFFAOYSA-N |