N,N-diethyl-2-({[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
N,N-diethyl-2-({[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-oxazole-4-carboxamide
N,N-diethyl-2-({[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V009-0493 |
| Compound Name: | N,N-diethyl-2-({[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 507.61 |
| Molecular Formula: | C29 H34 F N3 O4 |
| Smiles: | CCN(CC)C(c1coc(COc2ccc3CCN(C(c4cccc(c4)F)c3c2)C(CC(C)C)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0666 |
| logD: | 5.0666 |
| logSw: | -4.8083 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.171 |
| InChI Key: | IUYSFPFACVLMET-NDEPHWFRSA-N |