3-{[(2H-1,3-benzodioxol-5-yl)methyl][(oxolan-2-yl)methyl]amino}-N-benzyl-2-(2-fluorophenoxy)propanamide
Chemical Structure Depiction of
3-{[(2H-1,3-benzodioxol-5-yl)methyl][(oxolan-2-yl)methyl]amino}-N-benzyl-2-(2-fluorophenoxy)propanamide
3-{[(2H-1,3-benzodioxol-5-yl)methyl][(oxolan-2-yl)methyl]amino}-N-benzyl-2-(2-fluorophenoxy)propanamide
Compound characteristics
| Compound ID: | V025-0490 |
| Compound Name: | 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(oxolan-2-yl)methyl]amino}-N-benzyl-2-(2-fluorophenoxy)propanamide |
| Molecular Weight: | 506.57 |
| Molecular Formula: | C29 H31 F N2 O5 |
| Salt: | not_available |
| Smiles: | C1CC(CN(CC(C(NCc2ccccc2)=O)Oc2ccccc2F)Cc2ccc3c(c2)OCO3)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0675 |
| logD: | 4.0479 |
| logSw: | -4.1885 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.621 |
| InChI Key: | JOXOQNAVSAONLI-UHFFFAOYSA-N |