N-ethyl-N-[(4-methoxyphenyl)methyl]-2-nitro-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]aniline
Chemical Structure Depiction of
N-ethyl-N-[(4-methoxyphenyl)methyl]-2-nitro-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]aniline
N-ethyl-N-[(4-methoxyphenyl)methyl]-2-nitro-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]aniline
Compound characteristics
Compound ID: | D349-3069 |
Compound Name: | N-ethyl-N-[(4-methoxyphenyl)methyl]-2-nitro-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]aniline |
Molecular Weight: | 431.45 |
Molecular Formula: | C23 H21 N5 O4 |
Smiles: | CCN(Cc1ccc(cc1)OC)c1ccc(cc1[N+]([O-])=O)c1nc(c2cccnc2)no1 |
Stereo: | ACHIRAL |
logP: | 4.1039 |
logD: | 4.0487 |
logSw: | -4.1327 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 84.225 |
InChI Key: | NKSIREKTLXZYOG-UHFFFAOYSA-N |