ethyl 4,5-dimethyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-0872 |
| Compound Name: | ethyl 4,5-dimethyl-2-(4-methyl-3-nitrobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 362.4 |
| Molecular Formula: | C17 H18 N2 O5 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(c1ccc(C)c(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0301 |
| logD: | -0.8844 |
| logSw: | -4.3033 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.958 |
| InChI Key: | JMMVKFIWXGIMOQ-UHFFFAOYSA-N |