2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenyl-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenyl-1,3,4-oxadiazole
2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenyl-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | C301-3885 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenyl-1,3,4-oxadiazole |
| Molecular Weight: | 280.28 |
| Molecular Formula: | C16 H12 N2 O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)c1nnc(c2ccccc2)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.1925 |
| logD: | 3.1925 |
| logSw: | -3.2135 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.264 |
| InChI Key: | DUIHNMQIUPIIJO-UHFFFAOYSA-N |