5-({[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
5-({[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide
5-({[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | V003-4480 |
| Compound Name: | 5-({[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 534.63 |
| Molecular Formula: | C31 H35 F N2 O5 |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccc(cc1)F)OCc1ccc(C(NCC2CCCO2)=O)o1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0841 |
| logD: | 5.0841 |
| logSw: | -4.8838 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.742 |
| InChI Key: | KLKZHIBFKPRNLD-UHFFFAOYSA-N |