N-benzyl-2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide
N-benzyl-2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V030-7754 |
| Compound Name: | N-benzyl-2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 553.72 |
| Molecular Formula: | C33 H35 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OCc1nc(cs1)C(NCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0048 |
| logD: | 7.0048 |
| logSw: | -5.6358 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.747 |
| InChI Key: | RLIDSUXTMOWYGC-YTTGMZPUSA-N |