N-benzyl-4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-2-nitroaniline
Chemical Structure Depiction of
N-benzyl-4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-2-nitroaniline
N-benzyl-4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-2-nitroaniline
Compound characteristics
| Compound ID: | D349-2558 |
| Compound Name: | N-benzyl-4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-2-nitroaniline |
| Molecular Weight: | 416.44 |
| Molecular Formula: | C23 H20 N4 O4 |
| Smiles: | CN(Cc1ccccc1)c1ccc(cc1[N+]([O-])=O)c1nc(c2ccccc2OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.9914 |
| logD: | 4.9914 |
| logSw: | -4.7655 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 75.009 |
| InChI Key: | CFNUAGWAKJBVAK-UHFFFAOYSA-N |