N-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-4-methylbenzamide
N-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V021-6500 |
| Compound Name: | N-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-4-methylbenzamide |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C18 H15 N3 O4 |
| Smiles: | Cc1ccc(cc1)C(NCc1nc(c2ccc3c(c2)OCO3)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.727 |
| logD: | 3.727 |
| logSw: | -3.965 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.11 |
| InChI Key: | ZISNOUCPOWDNRL-UHFFFAOYSA-N |