5-(2H-1,3-benzodioxol-5-yl)-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-3-carboxamide
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-3-carboxamide
5-(2H-1,3-benzodioxol-5-yl)-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-3-carboxamide
Compound characteristics
| Compound ID: | S341-0568 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-3-carboxamide |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C18 H15 N3 O4 |
| Smiles: | Cc1ccc(CNC(c2nc(c3ccc4c(c3)OCO4)on2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3368 |
| logD: | 3.3368 |
| logSw: | -3.4397 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.445 |
| InChI Key: | DTKMMCYSMOTBNC-UHFFFAOYSA-N |