N-butyl-2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)aniline
Chemical Structure Depiction of
N-butyl-2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)aniline
N-butyl-2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)aniline
Compound characteristics
| Compound ID: | D349-2264 |
| Compound Name: | N-butyl-2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)aniline |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C18 H18 N4 O3 |
| Smiles: | CCCCNc1ccc(cc1[N+]([O-])=O)c1nc(c2ccccc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.32 |
| logD: | 5.32 |
| logSw: | -5.3514 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.375 |
| InChI Key: | PCACHUXWSJOQCT-UHFFFAOYSA-N |