ethyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 1306-0142 |
| Compound Name: | ethyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 348.38 |
| Molecular Formula: | C16 H16 N2 O5 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6278 |
| logD: | -1.1864 |
| logSw: | -4.0906 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.259 |
| InChI Key: | VYMGESDVYHCXPR-UHFFFAOYSA-N |