methyl 5-({8-[3-(4-chlorophenyl)-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-(4-chlorophenyl)-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-(4-chlorophenyl)-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: | M177-0899 |
| Compound Name: | methyl 5-({8-[3-(4-chlorophenyl)-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: | 451.82 |
| Molecular Formula: | C21 H14 Cl N5 O5 |
| Smiles: | COC(c1ccc(CN2C(N3C=CC=C(C3=N2)c2nc(c3ccc(cc3)[Cl])no2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1465 |
| logD: | 4.1464 |
| logSw: | -4.5557 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 91.722 |
| InChI Key: | WEZOFZCGDAISIZ-UHFFFAOYSA-N |