N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitrobenzene-1-sulfonamide
N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | K781-1071 |
| Compound Name: | N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 375.4 |
| Molecular Formula: | C17 H17 N3 O5 S |
| Smiles: | CCOc1ccc(cc1)N(CCC#N)S(c1ccccc1[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6016 |
| logD: | 2.6016 |
| logSw: | -2.916 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.738 |
| InChI Key: | FEKKTWVRBFRGFH-UHFFFAOYSA-N |