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212069-94-8,MFCD24386518
Catalog No.:AA00C38U

212069-94-8 | SuMatriptan N-Oxide

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Technical Information
Catalog Number:
AA00C38U
Chemical Name:
SuMatriptan N-Oxide
CAS Number:
212069-94-8
Molecular Formula:
C14H21N3O3S
Molecular Weight:
311.3998
MDL Number:
MFCD24386518
SMILES:
CNS(=O)(=O)Cc1ccc2c(c1)c(c[nH]2)CC[N+](C)(C)[O-]
Properties
Computed Properties
 
Complexity:
447  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
6  
XLogP3:
0.4  

Literature
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Additional Info:
SDS
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