4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(propan-2-yl)aniline
Chemical Structure Depiction of
4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(propan-2-yl)aniline
4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(propan-2-yl)aniline
Compound characteristics
| Compound ID: | D349-2408 |
| Compound Name: | 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(propan-2-yl)aniline |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C18 H18 N4 O3 |
| Smiles: | CC(C)Nc1ccc(cc1[N+]([O-])=O)c1nc(c2cccc(C)c2)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.1502 |
| logD: | 5.1502 |
| logSw: | -5.1385 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.507 |
| InChI Key: | ORKDWKDOMIEGAG-UHFFFAOYSA-N |