2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide
2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V012-1675 |
| Compound Name: | 2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 517.5 |
| Molecular Formula: | C26 H26 F3 N3 O5 |
| Salt: | not_available |
| Smiles: | C1CC(CNC(c2coc(CN(Cc3ccc(cc3)C(F)(F)F)Cc3ccc4c(c3)OCO4)n2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5975 |
| logD: | 3.5962 |
| logSw: | -3.8167 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.268 |
| InChI Key: | IAGQGIDGKYWINT-HXUWFJFHSA-N |