2-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[2-(pyridin-2-yl)ethyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[2-(pyridin-2-yl)ethyl]-1,3-thiazole-4-carboxamide
2-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[2-(pyridin-2-yl)ethyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V001-0830 |
| Compound Name: | 2-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[2-(pyridin-2-yl)ethyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C31 H32 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OCc1nc(cs1)C(NCCc1ccccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2404 |
| logD: | 5.2402 |
| logSw: | -4.9688 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.132 |
| InChI Key: | RYPHXMNKIGVBFD-PMERELPUSA-N |