Home Amines 338403-15-9
338403-15-9,MFCD00127381
Catalog No.:AA00IP79

338403-15-9 | 4-{[(E)-2-[3-(2-chloro-6-fluorophenyl)-4-cyano-1,2-oxazol-5-yl]ethenyl]amino}benzoic acid

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Technical Information
Catalog Number:
AA00IP79
Chemical Name:
4-{[(E)-2-[3-(2-chloro-6-fluorophenyl)-4-cyano-1,2-oxazol-5-yl]ethenyl]amino}benzoic acid
CAS Number:
338403-15-9
Molecular Formula:
C19H11ClFN3O3
Molecular Weight:
383.7603
MDL Number:
MFCD00127381
SMILES:
N#Cc1c(/C=C/Nc2ccc(cc2)C(=O)O)onc1c1c(F)cccc1Cl
Properties
Computed Properties
 
Complexity:
602  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
5  
XLogP3:
4  

Literature
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SDS
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Tags:338403-15-9 Molecular Formula|338403-15-9 MDL|338403-15-9 SMILES|338403-15-9 4-{[(E)-2-[3-(2-chloro-6-fluorophenyl)-4-cyano-1,2-oxazol-5-yl]ethenyl]amino}benzoic acid