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CAS 155432-64-7

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2-(2-(2,4-Difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl)-4-(4-(2,2,3,3- tetrafluoropropoxy)phenyl)- 3(2H,4H)-1,2,4-triazolone

Description:
The chemical substance known as 2-(2-(2,4-Difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl)-4-(4-(2,2,3,3-tetrafluoropropoxy)phenyl)-3(2H,4H)-1,2,4-triazolone, with the CAS number 155432-64-7, is a complex organic compound characterized by its multi-functional structure. It features a triazolone core, which is indicative of its potential biological activity, particularly in agricultural or pharmaceutical applications. The presence of fluorinated groups, such as 2,4-difluorophenyl and 2,2,3,3-tetrafluoropropoxy, suggests enhanced lipophilicity and stability, which can influence its interaction with biological systems. The hydroxyl group contributes to its solubility and reactivity, while the triazole moiety may impart fungicidal or herbicidal properties. Overall, this compound's intricate structure and functional groups suggest it may exhibit significant pharmacological or agrochemical properties, making it of interest in research and development within these fields.
Formula:C23H20F6N6O3
InChI:InChI=1/C23H20F6N6O3/c1-14(22(37,9-33-12-30-11-31-33)18-7-2-15(24)8-19(18)25)35-21(36)34(13-32-35)16-3-5-17(6-4-16)38-10-23(28,29)20(26)27/h2-8,11-14,20,37H,9-10H2,1H3/t14-,22-/m1/s1
SMILES:C[C@H]([C@](Cn1cncn1)(c1ccc(cc1F)F)O)n1c(=O)n(cn1)c1ccc(cc1)OCC(C(F)F)(F)F
Synonyms:
  • Tak 187
  • 2-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1H-1,2,4-triazol-1-yl)butan-2-yl]-4-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
  • 2-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1H-1,2,4-triazol-1-yl)butan-2-yl]-4-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
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