2-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide
2-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V003-7753 |
| Compound Name: | 2-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 537.65 |
| Molecular Formula: | C29 H32 F N3 O4 S |
| Smiles: | CC(C)C(N1CCc2ccc(cc2C1c1cccc(c1)F)OCc1nc(cs1)C(NCC1CCCO1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8164 |
| logD: | 4.8164 |
| logSw: | -4.6135 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.929 |
| InChI Key: | HGGYKSNRYHDJRM-UHFFFAOYSA-N |