1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-{3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}propan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-{3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}propan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-{3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}propan-1-one
Compound characteristics
| Compound ID: | L308-1530 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-{3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}propan-1-one |
| Molecular Weight: | 480.59 |
| Molecular Formula: | C25 H28 N4 O4 S |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)c1nc(CCC(N2CCc3ccccc3C2)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0513 |
| logD: | 4.0513 |
| logSw: | -4.1273 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.075 |
| InChI Key: | LXWITXBNRXUKBQ-UHFFFAOYSA-N |