N-[3-(5-{[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)phenyl]acetamide
Chemical Structure Depiction of
N-[3-(5-{[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)phenyl]acetamide
N-[3-(5-{[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | 8430-1487 |
| Compound Name: | N-[3-(5-{[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)phenyl]acetamide |
| Molecular Weight: | 432.84 |
| Molecular Formula: | C18 H13 Cl N4 O5 S |
| Smiles: | CC(Nc1cccc(c1)c1nnc(o1)SCC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2475 |
| logD: | 3.2475 |
| logSw: | -3.9429 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.954 |
| InChI Key: | HTVQJHUZCUMWNI-UHFFFAOYSA-N |