2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}acetamide
Chemical Structure Depiction of
2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}acetamide
2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}acetamide
Compound characteristics
| Compound ID: | V029-4396 |
| Compound Name: | 2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}acetamide |
| Molecular Weight: | 444.87 |
| Molecular Formula: | C21 H21 Cl N4 O5 |
| Salt: | not_available |
| Smiles: | CCC(C)C(c1nc(c2ccc(cc2)[N+]([O-])=O)no1)NC(COc1ccc(cc1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.48 |
| logD: | 5.48 |
| logSw: | -6.0258 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.348 |
| InChI Key: | IMJUSCLTZCLUGM-UHFFFAOYSA-N |