5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}-N-(2-phenylethyl)-1,3,4-oxadiazole-2-carboxamide
Chemical Structure Depiction of
5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}-N-(2-phenylethyl)-1,3,4-oxadiazole-2-carboxamide
5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}-N-(2-phenylethyl)-1,3,4-oxadiazole-2-carboxamide
Compound characteristics
Compound ID: | C301-4918 |
Compound Name: | 5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}-N-(2-phenylethyl)-1,3,4-oxadiazole-2-carboxamide |
Molecular Weight: | 438.53 |
Molecular Formula: | C27 H26 N4 O2 |
Smiles: | C(CNC(c1nnc(c2ccc(CN3CCc4ccccc4C3)cc2)o1)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.8232 |
logD: | 3.5426 |
logSw: | -4.127 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.403 |
InChI Key: | WAJOCMBHIRPAHW-UHFFFAOYSA-N |