2-(2H-1,3-benzodioxol-5-yl)-5-(chloromethyl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-5-(chloromethyl)-1,3,4-oxadiazole
2-(2H-1,3-benzodioxol-5-yl)-5-(chloromethyl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | C301-3861 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-5-(chloromethyl)-1,3,4-oxadiazole |
| Molecular Weight: | 238.63 |
| Molecular Formula: | C10 H7 Cl N2 O3 |
| Smiles: | C1Oc2ccc(cc2O1)c1nnc(C[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 1.9605 |
| logD: | 1.9605 |
| logSw: | -2.2106 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.535 |
| InChI Key: | XHPQNABADLFREZ-UHFFFAOYSA-N |