ethyl 4,5-dimethyl-2-(2-methyl-3-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-(2-methyl-3-nitrobenzamido)thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-(2-methyl-3-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3772-3543 |
| Compound Name: | ethyl 4,5-dimethyl-2-(2-methyl-3-nitrobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 362.4 |
| Molecular Formula: | C17 H18 N2 O5 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(c1cccc(c1C)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9227 |
| logD: | -1.4298 |
| logSw: | -4.2996 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.958 |
| InChI Key: | YSIMAUGBYRDMAI-UHFFFAOYSA-N |