ethyl 5-acetyl-4-methyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-4-methyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate
ethyl 5-acetyl-4-methyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3772-3409 |
| Compound Name: | ethyl 5-acetyl-4-methyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 390.41 |
| Molecular Formula: | C18 H18 N2 O6 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(c1ccc(c(C)c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4229 |
| logD: | -1.4727 |
| logSw: | -4.0089 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.785 |
| InChI Key: | GOTGQDMTPRYMTQ-UHFFFAOYSA-N |