methyl {[4-(diethylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[4-(diethylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate
methyl {[4-(diethylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate
Compound characteristics
| Compound ID: | K783-4720 |
| Compound Name: | methyl {[4-(diethylsulfamoyl)-2-nitrophenyl]sulfanyl}acetate |
| Molecular Weight: | 362.42 |
| Molecular Formula: | C13 H18 N2 O6 S2 |
| Smiles: | CCN(CC)S(c1ccc(c(c1)[N+]([O-])=O)SCC(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3755 |
| logD: | 2.3755 |
| logSw: | -2.6796 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 84.994 |
| InChI Key: | NGHUELUBSADURK-UHFFFAOYSA-N |