ethyl 2-(4-chloro-3-nitrobenzamido)-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-chloro-3-nitrobenzamido)-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate
ethyl 2-(4-chloro-3-nitrobenzamido)-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8014-0944 |
| Compound Name: | ethyl 2-(4-chloro-3-nitrobenzamido)-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 493.97 |
| Molecular Formula: | C22 H24 Cl N3 O6 S |
| Smiles: | CCOC(c1c(C)c(C(NC2CCCCC2)=O)sc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6211 |
| logD: | -1.2189 |
| logSw: | -4.9865 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.097 |
| InChI Key: | MDWPGOHACZPPIT-UHFFFAOYSA-N |