ethyl [5-(4-nitrobenzamido)-1,3,4-thiadiazol-2-yl]acetate
Chemical Structure Depiction of
ethyl [5-(4-nitrobenzamido)-1,3,4-thiadiazol-2-yl]acetate
ethyl [5-(4-nitrobenzamido)-1,3,4-thiadiazol-2-yl]acetate
Compound characteristics
| Compound ID: | 8004-9862 |
| Compound Name: | ethyl [5-(4-nitrobenzamido)-1,3,4-thiadiazol-2-yl]acetate |
| Molecular Weight: | 336.32 |
| Molecular Formula: | C13 H12 N4 O5 S |
| Smiles: | CCOC(Cc1nnc(NC(c2ccc(cc2)[N+]([O-])=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1837 |
| logD: | 1.6877 |
| logSw: | -2.7186 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.91 |
| InChI Key: | HDNXJVFHOXYYMT-UHFFFAOYSA-N |