2-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
2-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
Compound characteristics
Compound ID: | V003-7813 |
Compound Name: | 2-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide |
Molecular Weight: | 523.67 |
Molecular Formula: | C29 H34 F N3 O3 S |
Smiles: | CC(C)CNC(c1csc(COc2ccc3CCN(C(c4cccc(c4)F)c3c2)C(C(C)(C)C)=O)n1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.2348 |
logD: | 6.2348 |
logSw: | -5.5129 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.546 |
InChI Key: | JNDBQJFGYGNHOT-SANMLTNESA-N |