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163213-38-5,MFCD02570753
Catalog No.:AA001TSQ

163213-38-5 | Methyl 4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxylate

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Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$100.00   $70.00
- +
250mg
95%
in stock  
$132.00   $93.00
- +
500mg
95%
in stock  
$222.00   $155.00
- +
1g
95%
in stock  
$331.00   $232.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001TSQ
Chemical Name:
Methyl 4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxylate
CAS Number:
163213-38-5
Molecular Formula:
C9H11N3O3
Molecular Weight:
209.2019
MDL Number:
MFCD02570753
SMILES:
COC(=O)c1nn2c(c1)C(=O)NCCC2
Properties
Computed Properties
 
Complexity:
282  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.1  

Downstream Synthesis Route

[1]JournalofOrganicChemistry,1999,vol.64,p.7751-7755

[1]Askew,BennyC.;Bednar,RodneyA.;Bednar,Bohumil;Claremon,DavidA.;Cook,JacquelynnJ.;McIntyre,CharlesJ.;Hunt,CecilaA.;Gould,RobertJ.;Lynch,RobertJ.;LynchJr.,JosephJ.;Gaul,StanleyL.;Stranieri,MariaT.;Sitko,GaryR.;Holahan,MarieA.;Glass,JoanD.;Hamill,Terrence;Gorham,LynnM.;Prueksaritanont,Thomayant;Baldwin,JohnJ.;Hartman,GeorgeD.[JournalofMedicinalChemistry,1997,vol.40,#12,p.1779-1788]

[1]JournalofMedicinalChemistry,1997,vol.40,p.1779-1788

Literature

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
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Tags:163213-38-5 Molecular Formula|163213-38-5 MDL|163213-38-5 SMILES|163213-38-5 Methyl 4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxylate