2-({5-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(4-nitrophenyl)ethan-1-one
Chemical Structure Depiction of
2-({5-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(4-nitrophenyl)ethan-1-one
2-({5-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(4-nitrophenyl)ethan-1-one
Compound characteristics
| Compound ID: | 8430-1456 |
| Compound Name: | 2-({5-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(4-nitrophenyl)ethan-1-one |
| Molecular Weight: | 401.4 |
| Molecular Formula: | C18 H15 N3 O6 S |
| Smiles: | COc1ccc(cc1)OCc1nnc(o1)SCC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8052 |
| logD: | 2.8052 |
| logSw: | -3.3103 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.401 |
| InChI Key: | RKFCJOZZJWRRIL-UHFFFAOYSA-N |