N-ethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Chemical Structure Depiction of
N-ethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
N-ethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Compound characteristics
| Compound ID: | D349-3611 |
| Compound Name: | N-ethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline |
| Molecular Weight: | 276.29 |
| Molecular Formula: | C13 H16 N4 O3 |
| Smiles: | CCNc1ccc(cc1[N+]([O-])=O)c1nc(C(C)C)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.3452 |
| logD: | 3.3452 |
| logSw: | -3.6969 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.43 |
| InChI Key: | FFIHOGJIYJRTLK-UHFFFAOYSA-N |