diethyl 3-methyl-5-(2-nitrobenzamido)thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 3-methyl-5-(2-nitrobenzamido)thiophene-2,4-dicarboxylate
diethyl 3-methyl-5-(2-nitrobenzamido)thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 3772-0462 |
| Compound Name: | diethyl 3-methyl-5-(2-nitrobenzamido)thiophene-2,4-dicarboxylate |
| Molecular Weight: | 406.41 |
| Molecular Formula: | C18 H18 N2 O7 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(c1ccccc1[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2963 |
| logD: | -2.6096 |
| logSw: | -3.9149 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.712 |
| InChI Key: | DWOVNDOEHUHHJQ-UHFFFAOYSA-N |