2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-2-yl)methyl]aniline
Chemical Structure Depiction of
2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-2-yl)methyl]aniline
2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-2-yl)methyl]aniline
Compound characteristics
| Compound ID: | D349-3634 |
| Compound Name: | 2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-2-yl)methyl]aniline |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C17 H17 N5 O3 |
| Smiles: | CC(C)c1nc(c2ccc(c(c2)[N+]([O-])=O)NCc2ccccn2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.5153 |
| logD: | 3.5152 |
| logSw: | -3.8246 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.076 |
| InChI Key: | XXHXSZYKOZEBRY-UHFFFAOYSA-N |