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CAS 889062-06-0

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N-tert-Butyl-3-(2-hydroxypropan-2-yl)-5-oxo-2,5-dihydro-1H-1,2,4-triazole-1-carboxamide

Description:
N-tert-Butyl-3-(2-hydroxypropan-2-yl)-5-oxo-2,5-dihydro-1H-1,2,4-triazole-1-carboxamide is a chemical compound characterized by its complex structure, which includes a triazole ring, a carboxamide functional group, and a tert-butyl substituent. This compound typically exhibits properties associated with both hydrophilicity and lipophilicity due to the presence of hydroxyl and bulky alkyl groups. It may display moderate solubility in polar solvents, influenced by the hydroxyl group, while the tert-butyl group contributes to its steric bulk. The triazole moiety is known for its biological activity, often serving as a scaffold in pharmaceuticals, particularly in antifungal and antimicrobial agents. The compound's stability and reactivity can be affected by the presence of the carboxamide and keto functionalities, which may participate in hydrogen bonding and other intermolecular interactions. Overall, this compound's unique structural features suggest potential applications in medicinal chemistry and material science, although specific biological activities and applications would require further investigation.
Formula:C10H18N4O3
InChI:InChI=1/C10H18N4O3/c1-9(2,3)12-8(16)14-7(15)11-6(13-14)10(4,5)17/h17H,1-5H3,(H,12,16)(H,11,13,15)
SMILES:CC(C)(C)N=C(n1c(=O)nc(C(C)(C)O)[nH]1)O
Synonyms:
  • 1H-1,2,4-triazole-1-carboxamide, N-(1,1-dimethylethyl)-4,5-dihydro-3-(1-hydroxy-1-methylethyl)-5-oxo-
  • N-tert-butyl-3-(2-hydroxypropan-2-yl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-1-carboxamide
  • N-tert-butyl-3-(1-hydroxy-1-methyl-ethyl)-5-oxo-4H-1,2,4-triazole-1-carboxamide
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