3-chloro-N-{4-[5-(3-methyl-4-nitrophenyl)-1,2,4-oxadiazol-3-yl]phenyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{4-[5-(3-methyl-4-nitrophenyl)-1,2,4-oxadiazol-3-yl]phenyl}benzamide
3-chloro-N-{4-[5-(3-methyl-4-nitrophenyl)-1,2,4-oxadiazol-3-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | K629-0176 |
| Compound Name: | 3-chloro-N-{4-[5-(3-methyl-4-nitrophenyl)-1,2,4-oxadiazol-3-yl]phenyl}benzamide |
| Molecular Weight: | 434.84 |
| Molecular Formula: | C22 H15 Cl N4 O4 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)c1nc(c2ccc(cc2)NC(c2cccc(c2)[Cl])=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 6.0437 |
| logD: | 6.0435 |
| logSw: | -6.1656 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.816 |
| InChI Key: | CTEDYCRYVLVWHQ-UHFFFAOYSA-N |