3-ethyl-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-ethyl-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole
3-ethyl-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D349-3174 |
| Compound Name: | 3-ethyl-5-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 288.3 |
| Molecular Formula: | C14 H16 N4 O3 |
| Smiles: | CCc1nc(c2ccc(c(c2)[N+]([O-])=O)N2CCCC2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.1056 |
| logD: | 3.1056 |
| logSw: | -3.4001 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.504 |
| InChI Key: | TUSBQVSHYRCOHM-UHFFFAOYSA-N |