ethyl 2-(4-chloro-3-nitrobenzamido)-5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-chloro-3-nitrobenzamido)-5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
ethyl 2-(4-chloro-3-nitrobenzamido)-5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3176-5131 |
| Compound Name: | ethyl 2-(4-chloro-3-nitrobenzamido)-5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 590.36 |
| Molecular Formula: | C23 H16 Cl2 F3 N3 O6 S |
| Smiles: | CCOC(c1c(C)c(C(Nc2cc(ccc2[Cl])C(F)(F)F)=O)sc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8879 |
| logD: | -0.5906 |
| logSw: | -6.3407 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.352 |
| InChI Key: | JWIJPKGDQGUNPG-UHFFFAOYSA-N |