5-(4-FLUOROPHENYL)-3-HYDROXY-2-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-4-(1H-1,2,4-TRIAZOL-1-YL)-2-CYCLOHEXEN-1-ONE

5-(4-fluorophenyl)-3-hydroxy-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)-4-(1H-1,2,4-triazol-1-yl)cyclohex-2-en-1-one · 5-(4-FLUOROPHENYL)-3-HYDROXY-2-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-4-(1H-1,2,4-TRIAZOL-1-YL)-2-CYCLOHEXEN-1-ONE · 2-Cyclohexen-1-one, 5-(4-fluorophenyl)-3-hydroxy-2-(1,2,3,4-tetrahydro-1-isoquinolinyl)-4-(1H-1,2,4-triazol-1-yl)- · 4'-fluoro-5-hydroxy-4-(1,2,3,4-tetrahydroisoquinolin-1-yl)-6-(1H-1,2,4-triazol-1-yl)-1,6-dihydro-[1,1'-biphenyl]-3(2H)-one

https://huagongshe.com/ja/chemical/178706607

5-(4-FLUOROPHENYL)-3-HYDROXY-2-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-4-(1H-1,2,4-TRIAZOL-1-YL)-2-CYCLOHEXEN-1-ONE の分子構造式

識別子と物理属性

CAS No.	1005106-96-6
分子式	C23H21FN4O2
平均分子量	404.44 g/mol
SMILES	O=C1CC(c2ccc(F)cc2)C(n2cncn2)C(O)=C1C1NCCc2ccccc21
InChIKey	FXLNDTHFEDSOJP-UHFFFAOYSA-N

化学・物理的性質

沸点	634.9±65.0 °C(Predicted)
密度	1.43±0.1 g/cm3(Predicted)
pKa（酸解離定数）	2.14±0.58(Predicted)