ethyl 5-methyl-2-(4-nitrobenzamido)-4-phenylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-methyl-2-(4-nitrobenzamido)-4-phenylthiophene-3-carboxylate
ethyl 5-methyl-2-(4-nitrobenzamido)-4-phenylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3720-3480 |
| Compound Name: | ethyl 5-methyl-2-(4-nitrobenzamido)-4-phenylthiophene-3-carboxylate |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H18 N2 O5 S |
| Smiles: | CCOC(c1c(c2ccccc2)c(C)sc1NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.875 |
| logD: | 3.5878 |
| logSw: | -4.7459 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.988 |
| InChI Key: | CXERDLKLHFNXBF-UHFFFAOYSA-N |