N-cyclopropyl-2-{[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
Chemical Structure Depiction of
N-cyclopropyl-2-{[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
N-cyclopropyl-2-{[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
Compound characteristics
| Compound ID: | V003-7668 |
| Compound Name: | N-cyclopropyl-2-{[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide |
| Molecular Weight: | 438.54 |
| Molecular Formula: | C26 H31 F N2 O3 |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccc(cc1)F)OC(C)C(NC1CC1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8186 |
| logD: | 4.8186 |
| logSw: | -4.5007 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.864 |
| InChI Key: | JBCNTMGETWHGMS-UHFFFAOYSA-N |