ethyl [2-nitro-4-(propylcarbamoyl)benzene-1-sulfonyl]acetate
Chemical Structure Depiction of
ethyl [2-nitro-4-(propylcarbamoyl)benzene-1-sulfonyl]acetate
ethyl [2-nitro-4-(propylcarbamoyl)benzene-1-sulfonyl]acetate
Compound characteristics
| Compound ID: | K781-9611 |
| Compound Name: | ethyl [2-nitro-4-(propylcarbamoyl)benzene-1-sulfonyl]acetate |
| Molecular Weight: | 358.37 |
| Molecular Formula: | C14 H18 N2 O7 S |
| Smiles: | CCCNC(c1ccc(c(c1)[N+]([O-])=O)S(CC(=O)OCC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6414 |
| logD: | 1.6414 |
| logSw: | -2.5903 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.04 |
| InChI Key: | LYYVNGNOFLIDKK-UHFFFAOYSA-N |