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2126178-55-8
Catalog No.:AA01EQ7O

2126178-55-8 | 4-[4-[[[[4-chloro-3-(trifluoromethyl)phenyl]amino]carbonyl]amino]-3-fluorophenoxy]-N-(methyl-13C-d3)-2-pyridinecarboxamide

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1mg
≥99% deuterated forms (d1-d3)
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$656.00   $459.00
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Technical Information
Catalog Number:
AA01EQ7O
Chemical Name:
4-[4-[[[[4-chloro-3-(trifluoromethyl)phenyl]amino]carbonyl]amino]-3-fluorophenoxy]-N-(methyl-13C-d3)-2-pyridinecarboxamide
CAS Number:
2126178-55-8
Molecular Formula:
C21H12ClD3F4N4O3
Molecular Weight:
486.8266
SMILES:
O=C(Nc1ccc(cc1F)Oc1ccnc(c1)C(=O)N[13C]([2H])([2H])[2H])Nc1ccc(c(c1)C(F)(F)F)Cl
Properties
Computed Properties
 
Complexity:
686  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
4  
Rotatable Bond Count:
5  
XLogP3:
4.2  

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Tags:2126178-55-8 Molecular Formula|2126178-55-8 MDL|2126178-55-8 SMILES|2126178-55-8 4-[4-[[[[4-chloro-3-(trifluoromethyl)phenyl]amino]carbonyl]amino]-3-fluorophenoxy]-N-(methyl-13C-d3)-2-pyridinecarboxamide