2-{[2-acetyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(4-fluorophenyl)methyl]butanamide
Chemical Structure Depiction of
2-{[2-acetyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(4-fluorophenyl)methyl]butanamide
2-{[2-acetyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(4-fluorophenyl)methyl]butanamide
Compound characteristics
| Compound ID: | V023-4046 |
| Compound Name: | 2-{[2-acetyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(4-fluorophenyl)methyl]butanamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C29 H31 F N2 O3 |
| Smiles: | CCC(C(NCc1ccc(cc1)F)=O)Oc1ccc2CCN(C(c3cccc(C)c3)c2c1)C(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2141 |
| logD: | 5.2141 |
| logSw: | -5.0732 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.686 |
| InChI Key: | BEGYZZZJTWSRKZ-UHFFFAOYSA-N |