5-(2H-1,3-benzodioxol-5-yl)-3-[1-(3-chlorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-3-[1-(3-chlorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
5-(2H-1,3-benzodioxol-5-yl)-3-[1-(3-chlorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | P507-0589 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-3-[1-(3-chlorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole |
| Molecular Weight: | 367.75 |
| Molecular Formula: | C17 H10 Cl N5 O3 |
| Smiles: | C1Oc2ccc(cc2O1)c1nc(c2cn(c3cccc(c3)[Cl])nn2)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.9897 |
| logD: | 3.9897 |
| logSw: | -4.4149 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 75.125 |
| InChI Key: | ZBOONOJLFWNQBQ-UHFFFAOYSA-N |