N-[3-(4-ethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[3-(4-ethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluorobenzamide
N-[3-(4-ethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluorobenzamide
Compound characteristics
Compound ID: | G952-3031 |
Compound Name: | N-[3-(4-ethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluorobenzamide |
Molecular Weight: | 383.4 |
Molecular Formula: | C18 H14 F N5 O2 S |
Smiles: | CCOc1ccc(cc1)c1nnc2n1nc(NC(c1cccc(c1)F)=O)s2 |
Stereo: | ACHIRAL |
logP: | 3.7944 |
logD: | 3.6112 |
logSw: | -3.9367 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.249 |
InChI Key: | OQZZVESZEQOEHJ-UHFFFAOYSA-N |