ethyl 4-ethyl-5-methyl-2-(4-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-ethyl-5-methyl-2-(4-nitrobenzamido)thiophene-3-carboxylate
ethyl 4-ethyl-5-methyl-2-(4-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0585 |
| Compound Name: | ethyl 4-ethyl-5-methyl-2-(4-nitrobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 362.4 |
| Molecular Formula: | C17 H18 N2 O5 S |
| Smiles: | CCc1c(C(=O)OCC)c(NC(c2ccc(cc2)[N+]([O-])=O)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.0956 |
| logD: | 0.2687 |
| logSw: | -4.3591 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.259 |
| InChI Key: | QTPTZIUYLZJVGL-UHFFFAOYSA-N |