2-({5-[(4-chloro-2-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(2-chloro-5-nitrophenyl)ethan-1-one
Chemical Structure Depiction of
2-({5-[(4-chloro-2-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(2-chloro-5-nitrophenyl)ethan-1-one
2-({5-[(4-chloro-2-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(2-chloro-5-nitrophenyl)ethan-1-one
Compound characteristics
| Compound ID: | 8430-1489 |
| Compound Name: | 2-({5-[(4-chloro-2-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(2-chloro-5-nitrophenyl)ethan-1-one |
| Molecular Weight: | 454.29 |
| Molecular Formula: | C18 H13 Cl2 N3 O5 S |
| Smiles: | Cc1cc(ccc1OCc1nnc(o1)SCC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0184 |
| logD: | 5.0184 |
| logSw: | -5.1236 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.944 |
| InChI Key: | GLQGNSNFGHOTIN-UHFFFAOYSA-N |