N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | P508-0731 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 404.38 |
| Molecular Formula: | C20 H16 N6 O4 |
| Smiles: | Cc1ccc(cc1)n1cc(c2nc(C(Nc3ccc4c(c3)OCCO4)=O)on2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.4097 |
| logD: | 2.4085 |
| logSw: | -2.9327 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.195 |
| InChI Key: | RJKRIQSNMUPHKN-UHFFFAOYSA-N |