2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(2-methylphenyl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(2-methylphenyl)-1,3,4-oxadiazole
2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(2-methylphenyl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | C301-4985 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(2-methylphenyl)-1,3,4-oxadiazole |
| Molecular Weight: | 294.31 |
| Molecular Formula: | C17 H14 N2 O3 |
| Smiles: | Cc1ccccc1c1nnc(Cc2ccc3c(c2)OCO3)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.435 |
| logD: | 3.435 |
| logSw: | -3.6445 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.264 |
| InChI Key: | YATBPOHZDYBWBP-UHFFFAOYSA-N |