2-nitro-N-(2-phenylethyl)-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Chemical Structure Depiction of
2-nitro-N-(2-phenylethyl)-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
2-nitro-N-(2-phenylethyl)-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Compound characteristics
| Compound ID: | D349-3622 |
| Compound Name: | 2-nitro-N-(2-phenylethyl)-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C19 H20 N4 O3 |
| Smiles: | CC(C)c1nc(c2ccc(c(c2)[N+]([O-])=O)NCCc2ccccc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.6444 |
| logD: | 4.6444 |
| logSw: | -4.4481 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.375 |
| InChI Key: | ZQHUGZJWAKKWBB-UHFFFAOYSA-N |