diethyl 5-(2-chloro-5-nitrobenzamido)-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-(2-chloro-5-nitrobenzamido)-3-methylthiophene-2,4-dicarboxylate
diethyl 5-(2-chloro-5-nitrobenzamido)-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 8007-0942 |
| Compound Name: | diethyl 5-(2-chloro-5-nitrobenzamido)-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 440.86 |
| Molecular Formula: | C18 H17 Cl N2 O7 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0797 |
| logD: | -1.454 |
| logSw: | -4.798 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.013 |
| InChI Key: | JDQROWJXNBLSFG-UHFFFAOYSA-N |