N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,3-benzodioxole-5-carboxamide
N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | D101-0490 |
| Compound Name: | N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 357.75 |
| Molecular Formula: | C17 H12 Cl N3 O4 |
| Smiles: | C(c1nc(c2ccc(cc2)[Cl])no1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9001 |
| logD: | 3.9001 |
| logSw: | -4.5432 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.11 |
| InChI Key: | KAKKAWGCRAYIBT-UHFFFAOYSA-N |