2-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-propyl-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-propyl-1,3-thiazole-4-carboxamide
2-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-propyl-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V003-7741 |
| Compound Name: | 2-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-propyl-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 495.62 |
| Molecular Formula: | C27 H30 F N3 O3 S |
| Smiles: | CCCNC(c1csc(COc2ccc3CCN(C(c4cccc(c4)F)c3c2)C(C(C)C)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4916 |
| logD: | 5.4916 |
| logSw: | -5.4077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.388 |
| InChI Key: | PMNMBQMMTMMAHT-VWLOTQADSA-N |