ethyl 2-(4-nitrobenzamido)-1,3-benzothiazole-6-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-nitrobenzamido)-1,3-benzothiazole-6-carboxylate
ethyl 2-(4-nitrobenzamido)-1,3-benzothiazole-6-carboxylate
Compound characteristics
| Compound ID: | 0478-0689 |
| Compound Name: | ethyl 2-(4-nitrobenzamido)-1,3-benzothiazole-6-carboxylate |
| Molecular Weight: | 371.37 |
| Molecular Formula: | C17 H13 N3 O5 S |
| Smiles: | CCOC(c1ccc2c(c1)sc(NC(c1ccc(cc1)[N+]([O-])=O)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.412 |
| logD: | 4.4087 |
| logSw: | -4.328 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.226 |
| InChI Key: | KBHDGIGTTLQEGR-UHFFFAOYSA-N |