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692287-41-5,MFCD03102548
Catalog No.:AA00IQ7X

692287-41-5 | 3-{[6-oxo-1-phenyl-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl]sulfanyl}propanoic acid

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  • Technical Information
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Technical Information
Catalog Number:
AA00IQ7X
Chemical Name:
3-{[6-oxo-1-phenyl-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl]sulfanyl}propanoic acid
CAS Number:
692287-41-5
Molecular Formula:
C14H11F3N2O3S
Molecular Weight:
344.3089
MDL Number:
MFCD03102548
SMILES:
OC(=O)CCSc1nc(cc(=O)n1c1ccccc1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
540  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
2.3  

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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Tags:692287-41-5 Molecular Formula|692287-41-5 MDL|692287-41-5 SMILES|692287-41-5 3-{[6-oxo-1-phenyl-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl]sulfanyl}propanoic acid