1-(3,4-dihydroquinolin-1(2H)-yl)-2-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | E716-0045 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)ethan-1-one |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C21 H21 N3 O3 S |
| Smiles: | COc1ccc(cc1)c1nc(CSCC(N2CCCc3ccccc23)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.6627 |
| logD: | 4.6627 |
| logSw: | -4.3463 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.911 |
| InChI Key: | JAPGHNKPYRLFJW-UHFFFAOYSA-N |