ethyl 5-acetyl-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate
ethyl 5-acetyl-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3366-4290 |
| Compound Name: | ethyl 5-acetyl-2-(4-chloro-3-nitrobenzamido)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 410.83 |
| Molecular Formula: | C17 H15 Cl N2 O6 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2197 |
| logD: | -3.044 |
| logSw: | -4.0432 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.785 |
| InChI Key: | NYBNQXYJJSOLON-UHFFFAOYSA-N |