2-({[2-acetyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({[2-acetyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide
2-({[2-acetyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V024-1368 |
| Compound Name: | 2-({[2-acetyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 509.6 |
| Molecular Formula: | C27 H28 F N3 O4 S |
| Smiles: | CC(N1CCc2ccc(cc2C1c1cccc(c1)F)OCc1nc(cs1)C(NCC1CCCO1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7822 |
| logD: | 3.7822 |
| logSw: | -3.8186 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.397 |
| InChI Key: | YTMCPWZABULIAV-UHFFFAOYSA-N |