ethyl {[4-(dibutylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[4-(dibutylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate
ethyl {[4-(dibutylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate
Compound characteristics
| Compound ID: | K783-4914 |
| Compound Name: | ethyl {[4-(dibutylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate |
| Molecular Weight: | 432.56 |
| Molecular Formula: | C18 H28 N2 O6 S2 |
| Smiles: | CCCCN(CCCC)S(c1ccc(c(c1)[N+]([O-])=O)SCC(=O)OCC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9814 |
| logD: | 4.9814 |
| logSw: | -4.5432 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 85.081 |
| InChI Key: | IJOFFUDCGCRXGG-UHFFFAOYSA-N |