2-nitro-N-(propan-2-yl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]aniline
Chemical Structure Depiction of
2-nitro-N-(propan-2-yl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]aniline
2-nitro-N-(propan-2-yl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]aniline
Compound characteristics
| Compound ID: | D349-2834 |
| Compound Name: | 2-nitro-N-(propan-2-yl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]aniline |
| Molecular Weight: | 414.42 |
| Molecular Formula: | C20 H22 N4 O6 |
| Smiles: | CC(C)Nc1ccc(cc1[N+]([O-])=O)c1nc(c2cc(c(c(c2)OC)OC)OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.2633 |
| logD: | 4.2633 |
| logSw: | -4.4679 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.485 |
| InChI Key: | CZJBECYJCVDOIA-UHFFFAOYSA-N |