ethyl 2-(3-methyl-4-nitrobenzamido)-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-methyl-4-nitrobenzamido)-1-benzothiophene-3-carboxylate
ethyl 2-(3-methyl-4-nitrobenzamido)-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | F066-0573 |
| Compound Name: | ethyl 2-(3-methyl-4-nitrobenzamido)-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 384.41 |
| Molecular Formula: | C19 H16 N2 O5 S |
| Smiles: | CCOC(c1c2ccccc2sc1NC(c1ccc(c(C)c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5296 |
| logD: | 3.2904 |
| logSw: | -4.4636 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.687 |
| InChI Key: | NYTPNZNZRHZNOC-UHFFFAOYSA-N |