Home Carboxys 7H-Thiazolo[3,2-a]pyrimidine-5-carboxylic acid, 7-oxo-

7H-Thiazolo[3,2-a]pyrimidine-5-carboxylic acid, 7-oxo-

CAS No.:
33304-84-6
Catalog Number:
AG007GDK
Molecular Formula:
C7H4N2O3S
Molecular Weight:
196.1833
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Product Description
Catalog Number:
AG007GDK
Chemical Name:
7H-Thiazolo[3,2-a]pyrimidine-5-carboxylic acid, 7-oxo-
CAS Number:
33304-84-6
Molecular Formula:
C7H4N2O3S
Molecular Weight:
196.1833
MDL Number:
MFCD12827515
IUPAC Name:
7-oxo-[1,3]thiazolo[3,2-a]pyrimidine-5-carboxylic acid
InChI:
InChI=1S/C7H4N2O3S/c10-5-3-4(6(11)12)9-1-2-13-7(9)8-5/h1-3H,(H,11,12)
InChI Key:
JNYBSNXHAWFFFZ-UHFFFAOYSA-N
SMILES:
O=c1nc2sccn2c(c1)C(=O)O
Properties
Complexity:
383  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.994g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.18g/mol
Monoisotopic Mass:
195.994g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
95.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties