N-[(4-methoxyphenyl)methyl]-N-methyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-N-methyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline
N-[(4-methoxyphenyl)methyl]-N-methyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline
Compound characteristics
| Compound ID: | D349-3352 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-N-methyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline |
| Molecular Weight: | 417.42 |
| Molecular Formula: | C22 H19 N5 O4 |
| Smiles: | CN(Cc1ccc(cc1)OC)c1ccc(cc1[N+]([O-])=O)c1nc(c2ccncc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.1911 |
| logD: | 4.191 |
| logSw: | -4.3116 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 84.351 |
| InChI Key: | BDEHTULQZROLNC-UHFFFAOYSA-N |