N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L957-0255 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C25 H29 N5 O4 S |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)c1nnc(C(NCCCN2CCc3ccccc3C2)=O)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4866 |
| logD: | 1.3368 |
| logSw: | -2.8793 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.73 |
| InChI Key: | ZMJPOJSLIGCWTH-UHFFFAOYSA-N |