N-ethyl-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-ethyl-2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide
N-ethyl-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: | V030-7778 |
| Compound Name: | N-ethyl-2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 491.65 |
| Molecular Formula: | C28 H33 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCNC(c1csc(COc2ccc3CCN(C(c4ccc(C)cc4)c3c2)C(CC(C)C)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.644 |
| logD: | 5.644 |
| logSw: | -5.3621 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.645 |
| InChI Key: | OOTMZAVTWBEIRZ-MHZLTWQESA-N |