4-methoxy-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-nitro-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
4-methoxy-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-nitro-N-(propan-2-yl)benzamide
4-methoxy-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-nitro-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | C599-0388 |
| Compound Name: | 4-methoxy-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-nitro-N-(propan-2-yl)benzamide |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C21 H22 N4 O5 |
| Smiles: | CC(C)N(Cc1nc(c2ccc(C)cc2)no1)C(c1ccc(c(c1)[N+]([O-])=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1177 |
| logD: | 4.1177 |
| logSw: | -4.3368 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.247 |
| InChI Key: | JFTRIRTYBXXQNZ-UHFFFAOYSA-N |