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4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)Methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)Methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3R)-2-hydroxypentan-3-yl)-1H-1,2,4-triazol-5(4H)-one
4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)Methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)Methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3R)-2-hydroxypentan-3-yl)-1H-1,2,4-triazol-5(4H)-one
化学名:4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)Methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)Methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3R)-2-hydroxypentan-3-yl)-1H-1,2,4-triazol-5(4H)-one
CAS番号.170985-61-2
英語名:4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)Methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)Methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3R)-2-hydroxypentan-3-yl)-1H-1,2,4-triazol-5(4H)-one
CBNumberCB62716055
MFC37H42F2N8O4
MW700.78
MOL File170985-61-2.mol
4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)Methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)Methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3R)-2-hydroxypentan-3-yl)-1H-1,2,4-triazol-5(4H)-one物理性質
| 沸点 | 850.7±75.0 °C(Predicted) |
| 比重(密度) | 1.36±0.1 g/cm3(Predicted) |
| 酸解離定数(Pka) | 14.72±0.20(Predicted) |
| InChIKey | RAGOYPUPXAKGKH-XDOGIQCTNA-N |
| SMILES | N1([C@H](CC)[C@H](O)C)C(=O)N(C2=CC=C(N3CCN(C4=CC=C(OC[C@H]5C[C@](CN6C=NC=N6)(C6=CC=C(F)C=C6F)OC5)C=C4)CC3)C=C2)C=N1 |&1:1,4,24,26,r| |