N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}ethanediamide
Chemical Structure Depiction of
N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}ethanediamide
N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}ethanediamide
Compound characteristics
| Compound ID: | G574-0469 |
| Compound Name: | N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}ethanediamide |
| Molecular Weight: | 453.45 |
| Molecular Formula: | C21 H16 F N5 O4 S |
| Smiles: | C(CNC(C(Nc1ccc2c(c1)OCO2)=O)=O)c1csc2nc(c3cccc(c3)F)nn12 |
| Stereo: | ACHIRAL |
| logP: | 2.9748 |
| logD: | 2.2265 |
| logSw: | -3.4484 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.176 |
| InChI Key: | MHWPGIGZZXAEOS-UHFFFAOYSA-N |