4-methoxy-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-nitrobenzamide
Chemical Structure Depiction of
4-methoxy-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-nitrobenzamide
4-methoxy-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3694 |
| Compound Name: | 4-methoxy-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-nitrobenzamide |
| Molecular Weight: | 370.4 |
| Molecular Formula: | C13 H14 N4 O5 S2 |
| Smiles: | COCCSc1nnc(NC(c2ccc(c(c2)[N+]([O-])=O)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.1474 |
| logD: | 1.7757 |
| logSw: | -2.9669 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.289 |
| InChI Key: | LPLGNCFAQKGPKW-UHFFFAOYSA-N |