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Home Carboxys Methyl 7-oxo-7H-thiazolo[3,2-a]pyriMidine-5-carboxylate

Methyl 7-oxo-7H-thiazolo[3,2-a]pyriMidine-5-carboxylate

CAS No.:
33304-83-5
Catalog Number:
AG00CJE7
Molecular Formula:
C8H6N2O3S
Molecular Weight:
210.2098
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Product Description
Catalog Number:
AG00CJE7
Chemical Name:
Methyl 7-oxo-7H-thiazolo[3,2-a]pyriMidine-5-carboxylate
CAS Number:
33304-83-5
Molecular Formula:
C8H6N2O3S
Molecular Weight:
210.2098
MDL Number:
MFCD00277522
IUPAC Name:
methyl 7-oxo-[1,3]thiazolo[3,2-a]pyrimidine-5-carboxylate
InChI:
InChI=1S/C8H6N2O3S/c1-13-7(12)5-4-6(11)9-8-10(5)2-3-14-8/h2-4H,1H3
InChI Key:
YPIZITNNUSTRMY-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(=O)nc2n1ccs2
Properties
Complexity:
397  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.01g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.207g/mol
Monoisotopic Mass:
210.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties