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875930-21-5

875930-21-5 | Ethanone, 1-[2-[(2-fluorophenyl)amino]-4-methyl-5-thiazolyl]-

CAS No: 875930-21-5 Catalog No: AG004M4D MDL No:

Product Description

Catalog Number:
AG004M4D
Chemical Name:
Ethanone, 1-[2-[(2-fluorophenyl)amino]-4-methyl-5-thiazolyl]-
CAS Number:
875930-21-5
Molecular Formula:
C12H11FN2OS
Molecular Weight:
250.2919
IUPAC Name:
1-[2-(2-fluoroanilino)-4-methyl-1,3-thiazol-5-yl]ethanone
InChI:
InChI=1S/C12H11FN2OS/c1-7-11(8(2)16)17-12(14-7)15-10-6-4-3-5-9(10)13/h3-6H,1-2H3,(H,14,15)
InChI Key:
WJBQTWIJCRADGT-UHFFFAOYSA-N
SMILES:
Fc1ccccc1Nc1nc(c(s1)C(=O)C)C

Properties

Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.058g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.291g/mol
Monoisotopic Mass:
250.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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