N-cyclopropyl-2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide
N-cyclopropyl-2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V024-0085 |
| Compound Name: | N-cyclopropyl-2-({[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 489.64 |
| Molecular Formula: | C28 H31 N3 O3 S |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccccc1)OCc1nc(cs1)C(NC1CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4872 |
| logD: | 5.4872 |
| logSw: | -5.4304 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.804 |
| InChI Key: | KNOQUQKXZNMHKA-MHZLTWQESA-N |