Home Carboxys methyl 4-amino-3-(2-fluorophenyl)-1,2-thiazole-5-carboxylate

methyl 4-amino-3-(2-fluorophenyl)-1,2-thiazole-5-carboxylate

CAS No.:
1468470-94-1
Catalog Number:
AG01AG0V
Molecular Formula:
C11H9FN2O2S
Molecular Weight:
252.2648
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Product Description
Catalog Number:
AG01AG0V
Chemical Name:
methyl 4-amino-3-(2-fluorophenyl)-1,2-thiazole-5-carboxylate
CAS Number:
1468470-94-1
Molecular Formula:
C11H9FN2O2S
Molecular Weight:
252.2648
MDL Number:
MFCD21555154
IUPAC Name:
methyl 4-amino-3-(2-fluorophenyl)-1,2-thiazole-5-carboxylate
InChI:
InChI=1S/C11H9FN2O2S/c1-16-11(15)10-8(13)9(14-17-10)6-4-2-3-5-7(6)12/h2-5H,13H2,1H3
InChI Key:
PKOKDKIZBJAGNI-UHFFFAOYSA-N
SMILES:
COC(=O)c1snc(c1N)c1ccccc1F
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.037g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.263g/mol
Monoisotopic Mass:
252.037g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties