2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V024-0122 |
| Compound Name: | 2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 505.68 |
| Molecular Formula: | C29 H35 N3 O3 S |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccccc1)OCc1nc(cs1)C(NCC(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.171 |
| logD: | 6.171 |
| logSw: | -5.486 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.019 |
| InChI Key: | HAVPNUZYKXOEBT-NDEPHWFRSA-N |