ethyl {4-[(butan-2-yl)carbamoyl]-2-nitrobenzene-1-sulfonyl}acetate
Chemical Structure Depiction of
ethyl {4-[(butan-2-yl)carbamoyl]-2-nitrobenzene-1-sulfonyl}acetate
ethyl {4-[(butan-2-yl)carbamoyl]-2-nitrobenzene-1-sulfonyl}acetate
Compound characteristics
| Compound ID: | K781-8626 |
| Compound Name: | ethyl {4-[(butan-2-yl)carbamoyl]-2-nitrobenzene-1-sulfonyl}acetate |
| Molecular Weight: | 372.39 |
| Molecular Formula: | C15 H20 N2 O7 S |
| Smiles: | CCC(C)NC(c1ccc(c(c1)[N+]([O-])=O)S(CC(=O)OCC)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6954 |
| logD: | 1.6954 |
| logSw: | -2.6409 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.64 |
| InChI Key: | OVJFNWHSBNNCDB-JTQLQIEISA-N |