8-(azepan-1-ylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)-4H-chromen-4-one
8-(azepan-1-ylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)chromen-4-one
Also Known As: AE-641/40794528|SR-01000504304-1|8-(azepan-1-ylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)-4H-chromen-4-one|8-(azepan-1-ylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)chromen-4-one|8-(1-azepanylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)-4H-chromen-4-one|8-(azaperhydroepinylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)chromen-4-on e|8-(azepan-1-ium-1-ylmethyl)-4-oxo-3-phenyl-2-(trifluoromethyl)chromen-7-olate|8-[(AZEPAN-1-YL)METHYL]-7-HYDROXY-3-PHENYL-2-(TRIFLUOROMETHYL)-4H-CHROMEN-4-ONE
| Molecular Formula | C23H22F3NO3 |
|---|---|
| Molecular Weight | 417.15518 g/mol |
| LogP | 5.5604 |
| Topological Polar Surface Area | 53.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.15518 |
| Monoisotopic Mass | 417.15518 |
| Heavy Atoms | 30 |
| Complexity | 1098.6069 |
Chemical Identifiers
| CAS Number | 384366-75-0 |
|---|---|
| SMILES | C1CCCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)O |
Product Overview
8-(azepan-1-ylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)-4H-chromen-4-one (CAS 384366-75-0), with molecular formula C23H22F3NO3 and molecular weight 417.15518 g/mol. IUPAC: 8-(azepan-1-ylmethyl)-7-hydroxy-3-phenyl-2-(trifluoromethyl)chromen-4-one.