N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | L307-0675 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C25 H29 N5 O4 S |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)c1nc(C(NCCN2CCc3ccccc3C2)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.484 |
| logD: | 3.11 |
| logSw: | -3.6762 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.526 |
| InChI Key: | DOJAFWIPAAKSEL-UHFFFAOYSA-N |