N-butyl-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitroaniline
Chemical Structure Depiction of
N-butyl-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitroaniline
N-butyl-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitroaniline
Compound characteristics
| Compound ID: | D349-2619 |
| Compound Name: | N-butyl-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitroaniline |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C19 H20 N4 O4 |
| Smiles: | CCCCNc1ccc(cc1[N+]([O-])=O)c1nc(c2ccc(cc2)OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.4074 |
| logD: | 5.4074 |
| logSw: | -5.3822 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.918 |
| InChI Key: | PSCXYSIIVWNVNC-UHFFFAOYSA-N |