N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | L914-0667 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 447.49 |
| Molecular Formula: | C24 H25 N5 O4 |
| Smiles: | Cc1ccc2c(c1)N(Cc1nc(C(NCCCN3CCc4ccccc4C3)=O)on1)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.8658 |
| logD: | 1.716 |
| logSw: | -3.4016 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.906 |
| InChI Key: | GNQHEOHSOJPMRO-UHFFFAOYSA-N |