3-(2-methylphenyl)-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2-methylphenyl)-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole
3-(2-methylphenyl)-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D349-2322 |
| Compound Name: | 3-(2-methylphenyl)-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 350.38 |
| Molecular Formula: | C19 H18 N4 O3 |
| Smiles: | Cc1ccccc1c1nc(c2ccc(c(c2)[N+]([O-])=O)N2CCCC2)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.5761 |
| logD: | 4.5761 |
| logSw: | -4.4608 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.242 |
| InChI Key: | SEHAEMJNUJDMMY-UHFFFAOYSA-N |