2-{[2-(cyclopropanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(dimethylamino)ethyl]butanamide
Chemical Structure Depiction of
2-{[2-(cyclopropanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(dimethylamino)ethyl]butanamide
2-{[2-(cyclopropanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(dimethylamino)ethyl]butanamide
Compound characteristics
Compound ID: | V017-5386 |
Compound Name: | 2-{[2-(cyclopropanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(dimethylamino)ethyl]butanamide |
Molecular Weight: | 463.62 |
Molecular Formula: | C28 H37 N3 O3 |
Smiles: | CCC(C(NCCN(C)C)=O)Oc1ccc2CCN(C(c3ccc(C)cc3)c2c1)C(C1CC1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.4694 |
logD: | 2.807 |
logSw: | -4.2552 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.449 |
InChI Key: | QFIGXLQCEJWCTF-UHFFFAOYSA-N |