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252964-68-4,MFCD02956607
Catalog No.:AA00BBUZ

252964-68-4 | 2,4-Dihydro-4-[4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3h-1,2,4-triazol-3-one

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250mg
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$885.00   $620.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BBUZ
Chemical Name:
2,4-Dihydro-4-[4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3h-1,2,4-triazol-3-one
CAS Number:
252964-68-4
Molecular Formula:
C23H29N5O2
Molecular Weight:
407.5087
MDL Number:
MFCD02956607
SMILES:
CCC(n1ncn(c1=O)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)OC)C
Properties
Computed Properties
 
Complexity:
590  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
4.1  

Downstream Synthesis Route

[1]Patent:WO2014/197738,2014,A1

[1]Cai,Jin;Chen,Xixi;You,Haoyuan;Li,Xiaojing;Ji,Min[BioorganicandMedicinalChemistryLetters,2022,vol.76]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
Tags:252964-68-4 Molecular Formula|252964-68-4 MDL|252964-68-4 SMILES|252964-68-4 2,4-Dihydro-4-[4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3h-1,2,4-triazol-3-one