Home Carboxys Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate

Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate

CAS No.:
69785-97-3
Catalog Number:
AG005TMU
Molecular Formula:
C9H9N3O2S
Molecular Weight:
223.2517
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$955
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Product Description
Catalog Number:
AG005TMU
Chemical Name:
Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate
CAS Number:
69785-97-3
Molecular Formula:
C9H9N3O2S
Molecular Weight:
223.2517
MDL Number:
MFCD19053252
IUPAC Name:
ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate
InChI:
InChI=1S/C9H9N3O2S/c1-2-14-9(13)7-4-15-8-6(12-7)3-10-5-11-8/h3-5,12H,2H2,1H3
InChI Key:
QGKDEUWWLDPBNI-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1=CSc2c(N1)cncn2
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.042g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.25g/mol
Monoisotopic Mass:
223.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties