N,N-dimethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Chemical Structure Depiction of
N,N-dimethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
N,N-dimethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Compound characteristics
| Compound ID: | D349-3618 |
| Compound Name: | N,N-dimethyl-2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline |
| Molecular Weight: | 276.29 |
| Molecular Formula: | C13 H16 N4 O3 |
| Smiles: | CC(C)c1nc(c2ccc(c(c2)[N+]([O-])=O)N(C)C)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.2149 |
| logD: | 3.2149 |
| logSw: | -3.6275 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.5 |
| InChI Key: | XBHIKHWBCXMVIJ-UHFFFAOYSA-N |