4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[(4-methylphenyl)methyl]-2-nitroaniline
Chemical Structure Depiction of
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[(4-methylphenyl)methyl]-2-nitroaniline
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[(4-methylphenyl)methyl]-2-nitroaniline
Compound characteristics
| Compound ID: | D349-3161 |
| Compound Name: | 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[(4-methylphenyl)methyl]-2-nitroaniline |
| Molecular Weight: | 324.34 |
| Molecular Formula: | C17 H16 N4 O3 |
| Smiles: | Cc1ccc(CNc2ccc(cc2[N+]([O-])=O)c2nc(C)no2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.629 |
| logD: | 3.629 |
| logSw: | -3.947 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.146 |
| InChI Key: | JGCNLZHXYKCOOE-UHFFFAOYSA-N |