2-chloro-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-N-(propan-2-yl)benzamide
2-chloro-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | V029-1394 |
| Compound Name: | 2-chloro-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-N-(propan-2-yl)benzamide |
| Molecular Weight: | 414.85 |
| Molecular Formula: | C20 H19 Cl N4 O4 |
| Smiles: | CC(C)N(CCc1nc(c2cccc(c2)[N+]([O-])=O)no1)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9217 |
| logD: | 4.9217 |
| logSw: | -4.9189 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.896 |
| InChI Key: | AKBCDJHRRRIZID-UHFFFAOYSA-N |