2-chloro-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-5-nitro-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-5-nitro-N-(propan-2-yl)benzamide
2-chloro-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-5-nitro-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | C599-0393 |
| Compound Name: | 2-chloro-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-5-nitro-N-(propan-2-yl)benzamide |
| Molecular Weight: | 414.85 |
| Molecular Formula: | C20 H19 Cl N4 O4 |
| Smiles: | CC(C)N(Cc1nc(c2ccc(C)cc2)no1)C(c1cc(ccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2115 |
| logD: | 5.2115 |
| logSw: | -5.4912 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.918 |
| InChI Key: | HIWHIRCZYYCTNE-UHFFFAOYSA-N |