N-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
Compound ID: | G574-0302 |
Compound Name: | N-{2-[2-(3-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2H-1,3-benzodioxole-5-carboxamide |
Molecular Weight: | 410.42 |
Molecular Formula: | C20 H15 F N4 O3 S |
Smiles: | C(CNC(c1ccc2c(c1)OCO2)=O)c1csc2nc(c3cccc(c3)F)nn12 |
Stereo: | ACHIRAL |
logP: | 3.5662 |
logD: | 3.5662 |
logSw: | -3.9125 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.813 |
InChI Key: | HQGMRMSSNPMOIG-UHFFFAOYSA-N |