RefChem:371943
[4-(2,6-dimethoxypyrimidin-4-yl)piperazin-1-yl]-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone
Also Known As: Piperazine, 1-(2,6-dimethoxy-4-pyrimidinyl)-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-|[4-(2,6-Dimethoxypyrimidin-4-yl)piperazin-1-yl](4-{[7-(trifluoromethyl)quinolin-4-yl]amino}phenyl)methanone|[4-(2,6-dimethoxypyrimidin-4-yl)piperazin-1-yl]-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone|1-(2,6-dimethoxy-4-pyrimidinyl)-4-[4-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoyl]piperazine
| Molecular Formula | C27H25F3N6O3 |
|---|---|
| Molecular Weight | 538.19403 g/mol |
| LogP | 4.7668 |
| Topological Polar Surface Area | 92.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 538.19403 |
| Monoisotopic Mass | 538.19403 |
| Heavy Atoms | 39 |
| Complexity | 1466.6256 |
Chemical Identifiers
| CAS Number | 72141-49-2 |
|---|---|
| SMILES | COC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F)OC |
Product Overview
RefChem:371943 (CAS 72141-49-2), with molecular formula C27H25F3N6O3 and molecular weight 538.19403 g/mol. IUPAC: [4-(2,6-dimethoxypyrimidin-4-yl)piperazin-1-yl]-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone.