N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-nitrobenzamide
N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | D381-0180 |
| Compound Name: | N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-nitrobenzamide |
| Molecular Weight: | 386.38 |
| Molecular Formula: | C17 H14 N4 O5 S |
| Smiles: | [H]N(C(c1cccc(c1)[N+]([O-])=O)=O)c1nc(c2ccc(c(c2)OC)OC)ns1 |
| Stereo: | ACHIRAL |
| logP: | 3.5997 |
| logD: | 3.5319 |
| logSw: | -3.9437 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.56 |
| InChI Key: | AAIHAYVTOIZAAX-UHFFFAOYSA-N |