N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[2-(4-fluorobenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[2-(4-fluorobenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[2-(4-fluorobenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | M027-1209 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[2-(4-fluorobenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C23 H25 F N4 O4 S |
| Smiles: | C(CNC(c1nc(CCS(c2ccc(cc2)F)(=O)=O)no1)=O)CN1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 2.3778 |
| logD: | 1.228 |
| logSw: | -2.864 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.842 |
| InChI Key: | YWKAZYFPDMBEPJ-UHFFFAOYSA-N |