1-[7-({4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methoxy)-1-(4-methylphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one
Chemical Structure Depiction of
1-[7-({4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methoxy)-1-(4-methylphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one
1-[7-({4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methoxy)-1-(4-methylphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one
Compound characteristics
| Compound ID: | V001-0832 |
| Compound Name: | 1-[7-({4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methoxy)-1-(4-methylphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one |
| Molecular Weight: | 562.73 |
| Molecular Formula: | C31 H38 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OCc1nc(cs1)C(N1CCN(CC1)CCOC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4754 |
| logD: | 4.453 |
| logSw: | -4.3124 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.115 |
| InChI Key: | DGHAYRQSIZIQBH-PMERELPUSA-N |