4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide
Chemical Structure Depiction of
4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide
4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide
Compound characteristics
Compound ID: | 3617-0903 |
Compound Name: | 4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide |
Molecular Weight: | 322.34 |
Molecular Formula: | C13 H14 N4 O4 S |
Smiles: | CCc1nnc(NC(c2ccc(c(c2)[N+]([O-])=O)OCC)=O)s1 |
Stereo: | ACHIRAL |
logP: | 2.6737 |
logD: | 1.1738 |
logSw: | -3.204 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.661 |
InChI Key: | KLWKYHFXERAJMP-UHFFFAOYSA-N |