ethyl [2-(2-methoxy-4-nitroanilino)-2-oxoethanesulfonyl]acetate
Chemical Structure Depiction of
ethyl [2-(2-methoxy-4-nitroanilino)-2-oxoethanesulfonyl]acetate
ethyl [2-(2-methoxy-4-nitroanilino)-2-oxoethanesulfonyl]acetate
Compound characteristics
| Compound ID: | K781-0949 |
| Compound Name: | ethyl [2-(2-methoxy-4-nitroanilino)-2-oxoethanesulfonyl]acetate |
| Molecular Weight: | 360.34 |
| Molecular Formula: | C13 H16 N2 O8 S |
| Smiles: | CCOC(CS(CC(Nc1ccc(cc1OC)[N+]([O-])=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5184 |
| logD: | 0.4768 |
| logSw: | -2.4964 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.161 |
| InChI Key: | TZBSJIOQEFJJDM-UHFFFAOYSA-N |