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269055-76-7,MFCD18379329
Catalog No.:AA00C2QX

269055-76-7 | 6-Desamino 6-Chloro Etravirine

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  • Technical Information
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Technical Information
Catalog Number:
AA00C2QX
Chemical Name:
6-Desamino 6-Chloro Etravirine
CAS Number:
269055-76-7
Molecular Formula:
C20H13BrClN5O
Molecular Weight:
454.7071
MDL Number:
MFCD18379329
SMILES:
N#Cc1ccc(cc1)Nc1nc(Cl)c(c(n1)Oc1c(C)cc(cc1C)C#N)Br
Properties
Computed Properties
 
Complexity:
613  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
5.8  

Literature
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Additional Info:
SDS
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Tags:269055-76-7 Molecular Formula|269055-76-7 MDL|269055-76-7 SMILES|269055-76-7 6-Desamino 6-Chloro Etravirine