N-butyl-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-butyl-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(trifluoromethyl)benzamide
N-butyl-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V030-2144 |
| Compound Name: | N-butyl-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 462.43 |
| Molecular Formula: | C22 H21 F3 N4 O4 |
| Salt: | not_available |
| Smiles: | CCCCN(CCc1nc(c2ccc(cc2)[N+]([O-])=O)no1)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5381 |
| logD: | 5.5381 |
| logSw: | -5.3517 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.131 |
| InChI Key: | IJQMVUZCLQOYIP-UHFFFAOYSA-N |