4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-N-(propan-2-yl)aniline
Chemical Structure Depiction of
4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-N-(propan-2-yl)aniline
4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-N-(propan-2-yl)aniline
Compound characteristics
| Compound ID: | D349-3118 |
| Compound Name: | 4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-N-(propan-2-yl)aniline |
| Molecular Weight: | 262.27 |
| Molecular Formula: | C12 H14 N4 O3 |
| Smiles: | CC(C)Nc1ccc(cc1[N+]([O-])=O)c1nc(C)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.6598 |
| logD: | 2.6598 |
| logSw: | -3.0729 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.392 |
| InChI Key: | ZOZOCNJVZRIROQ-UHFFFAOYSA-N |