2-sec-Butyl-4-{4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one | CAS No. 106461-41-0
2-sec-Butyl-4-{4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one
Basic Information
CAS Number
106461-41-0
Molecular Formula
C22H27N5O2
Molecular Weight
393.49 g/mol
AD
Chemical Classification
Basic Physical Properties
Melting Point
177-179°C
Synonyms & References
English
- T-1330
- SCHEMBL2543291
- MLS000705004
- DTXSID60403376
- 1-(sec-Butyl)-4-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)phenyl)-1H-1,2,4-triazol-5(4H)-one
- CS-0169055
- NS00077759
- 106461-41-0
- 2,4-Dihydro-4-[4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazol-3-one; T 1330; 4-[4-[4-(4-Hydroxyphenyl)piperazin-1-yl]phenyl]-2-[(1RS)-1-methylpropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
- 2-(sec-butyl)-4-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
- FT-0657081
- 2,4-Dihydro-4-[4-[4-(4-hydroxyphenyl]-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazol-3-on
- AKOS015900401
- 2,4-Dihydro-4-[4-[4-(4-hydroxyphenyl]-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazol-3-one
- 2,4-dihydro-4-(4-(4-(4-hydroxyphenyl)-1-piperazinyl)phenyl)-2-(1-methylpropyl)-3h-1,2,4-triazol-3-one
- DS-14924
- FT-0664135
- EC 434-820-9
- O10328
- 2,4-Dihydro-4-[4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazole-3-one
- 2,4-DIHYDRO-4-(4-(4-(4-HYDROXYPHENYL)-1-PIPERAZINYL)PHENYL)-2-(1-METHYLPROPYL)-3H-1,2,4-TRIAZOLE-3-ONE
- AC-5588
- 2,4-Dihydro-4-[4-[4-hydroxyphenyl]-1-piperazinyl] phenyl]-2-
- 2,4-Dihydro-4-[4-[4-(4-hydroxyphenyl]-1-piperazinyl]-phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazol-3-one
- OBT4EGVAZU
- UNII-OBT4EGVAZU
- HMS2553F09
- 4-[4-[4-(4-Hydroxyphenyl)piperazin-1-yl]phenyl]-2-[(1RS)-1-methylpropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
- CHEMBL1310553
- (R)-1-(sec-Butyl)-4-[4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl]-1H-1,2,4-triazol-5(4H)-one
- 2,4-Dihydro-4-[(4-(4-hydroxyphenyl)-1-piperazinyl)phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazole-3-one
MDL Number
MFCD02093087
Customs Code
2933990090
FAQ
What are the physical and chemical properties of 2-sec-Butyl-4-{4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one (CAS: 106461-41-0)?
This compound has a crystalline form, with a molecular weight of approximately 553.67 g/mol. It is poorly soluble in water but soluble in organic solvents such as dimethyl sulfoxide (DMSO) and acetonitrile. The compound exhibits good stability under normal conditions but may react with strong acids and bases. It is reactive towards nucleophiles and may form adducts under certain conditions.
How is 2-sec-Butyl-4-{4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one (CAS: 106461-41-0) typically synthesized?
This compound is commonly synthesized through a multi-step process involving the coupling of 4-(4-hydroxyphenyl)piperazine and 2-sec-butyl-4-{4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl}isothiocyanate. The synthesis typically involves the use of a coupling agent such as diisopropylcarbodiimide (DIC) and a base like 4-dimethylaminopyridine (DMAP). The yield is generally around 60-70%, with good selectivity.
What industries use 2-sec-Butyl-4-{4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one (CAS: 106461-41-0)?
This compound is primarily used in the pharmaceutical industry as an intermediate for the synthesis of various drugs, particularly in the development of antifungal agents. It also has potential applications in the polymer industry for the development of advanced materials and in the sensor industry for detecting specific chemical compounds.
What precautions should be taken when handling 2-sec-Butyl-4-{4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one (CAS: 106461-41-0)?
When handling this compound, it is important to use proper personal protective equipment (PPE) including gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up immediately with appropriate absorbent materials. Refer to the safety data sheet (SDS) for detailed instructions and emergency procedures.
Related Compounds
![N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure](https://static.chemtradehub.com/structs/103/103687-96-3-8086.webp "N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure")
N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine
CAS Number:
103687-96-3
Molecular Formula:
C17H19NO5S
![5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure](https://static.chemtradehub.com/structs/112/112897-99-1-d1f4.webp "5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure")
5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine
CAS Number:
112897-99-1
Molecular Formula:
C30H31N3O7
![(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure](https://static.chemtradehub.com/structs/121/121055-10-5-583d.webp "(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure")
(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile
CAS Number:
121055-10-5
Molecular Formula:
C17H17NO4
![Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure](https://static.chemtradehub.com/structs/126/1263059-26-2-d6da.webp "Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure")
Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate
CAS Number:
1263059-26-2
Molecular Formula:
C8H6ClN3O2
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