methyl 5-({8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}methyl)furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-({8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}methyl)furan-2-carboxylate
methyl 5-({8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}methyl)furan-2-carboxylate
Compound characteristics
Compound ID: | M177-0900 |
Compound Name: | methyl 5-({8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}methyl)furan-2-carboxylate |
Molecular Weight: | 435.37 |
Molecular Formula: | C21 H14 F N5 O5 |
Smiles: | COC(c1ccc(CN2C(N3C=CC=C(C3=N2)c2nc(c3cccc(c3)F)no2)=O)o1)=O |
Stereo: | ACHIRAL |
logP: | 3.6727 |
logD: | 3.6727 |
logSw: | -3.9967 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 91.722 |
InChI Key: | DSICMPDANRYBAD-UHFFFAOYSA-N |