ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate
ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4223-7009 |
| Compound Name: | ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 536.39 |
| Molecular Formula: | C23 H19 Cl2 N3 O6 S |
| Smiles: | CCOC(c1c(C)c(C(Nc2ccc(C)c(c2)[Cl])=O)sc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.855 |
| logD: | -0.6236 |
| logSw: | -6.3001 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.049 |
| InChI Key: | YWFXMKBQUBQSJS-UHFFFAOYSA-N |