2-({[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
2-({[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V024-0111 |
| Compound Name: | 2-({[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 500.53 |
| Molecular Formula: | C28 H25 F N4 O4 |
| Smiles: | CC(N1CCc2ccc(cc2C1c1ccc(cc1)F)OCc1nc(co1)C(NCc1ccccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4971 |
| logD: | 3.4968 |
| logSw: | -3.6623 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.191 |
| InChI Key: | KGGBPMUUMKNEQQ-MHZLTWQESA-N |