N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methylphenyl)-1,2,4-oxadiazole-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methylphenyl)-1,2,4-oxadiazole-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methylphenyl)-1,2,4-oxadiazole-3-carboxamide
Compound characteristics
| Compound ID: | S341-0629 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methylphenyl)-1,2,4-oxadiazole-3-carboxamide |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C18 H15 N3 O4 |
| Smiles: | Cc1ccc(cc1)c1nc(C(NCc2ccc3c(c2)OCO3)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.4078 |
| logD: | 3.4078 |
| logSw: | -3.5828 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.445 |
| InChI Key: | NXHKILDVVILKLM-UHFFFAOYSA-N |