N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[(furan-2-yl)methyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[(furan-2-yl)methyl]-3-nitrobenzamide
N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[(furan-2-yl)methyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | V030-4707 |
| Compound Name: | N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[(furan-2-yl)methyl]-3-nitrobenzamide |
| Molecular Weight: | 462.42 |
| Molecular Formula: | C23 H18 N4 O7 |
| Salt: | not_available |
| Smiles: | C(CN(Cc1ccco1)C(c1cccc(c1)[N+]([O-])=O)=O)c1nc(c2ccc3c(c2)OCO3)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.1352 |
| logD: | 4.1352 |
| logSw: | -4.3994 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 105.745 |
| InChI Key: | WMRHQXVOOYOWHE-UHFFFAOYSA-N |