2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,4-dihydroquinolin-1(2H)-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,4-dihydroquinolin-1(2H)-yl)ethan-1-one
2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,4-dihydroquinolin-1(2H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | C292-0480 |
| Compound Name: | 2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,4-dihydroquinolin-1(2H)-yl)ethan-1-one |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C21 H19 N3 O4 S |
| Smiles: | C1Cc2ccccc2N(C1)C(CSc1nnc(C2COc3ccccc3O2)o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4512 |
| logD: | 3.4512 |
| logSw: | -3.7063 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.558 |
| InChI Key: | UGVTWMNOEXRRCJ-SFHVURJKSA-N |