2-{[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-phenylacetamide
Chemical Structure Depiction of
2-{[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-phenylacetamide
2-{[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-phenylacetamide
Compound characteristics
Compound ID: | V011-8354 |
Compound Name: | 2-{[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-phenylacetamide |
Molecular Weight: | 428.53 |
Molecular Formula: | C27 H28 N2 O3 |
Smiles: | CCC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OCC(Nc1ccccc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.303 |
logD: | 5.303 |
logSw: | -5.2494 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.982 |
InChI Key: | ZMTPMIKRYRNFGM-MHZLTWQESA-N |