2-[(adamantan-1-yl)methyl]-5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[(adamantan-1-yl)methyl]-5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazole
2-[(adamantan-1-yl)methyl]-5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | C301-5103 |
| Compound Name: | 2-[(adamantan-1-yl)methyl]-5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazole |
| Molecular Weight: | 338.4 |
| Molecular Formula: | C20 H22 N2 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)Cc1nnc(c2ccc3c(c2)OCO3)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.804 |
| logD: | 4.804 |
| logSw: | -5.0033 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.297 |
| InChI Key: | ZEZIJHWTPTUMQM-UHFFFAOYSA-N |