Home Carboxys Thieno[2,3-d]pyrimidine-6-carboxylic acid, 1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-

Thieno[2,3-d]pyrimidine-6-carboxylic acid, 1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-

CAS No.:
129177-39-5
Catalog Number:
AG000YXJ
Molecular Formula:
C9H8N2O4S
Molecular Weight:
240.2358
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Product Description
Catalog Number:
AG000YXJ
Chemical Name:
Thieno[2,3-d]pyrimidine-6-carboxylic acid, 1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-
CAS Number:
129177-39-5
Molecular Formula:
C9H8N2O4S
Molecular Weight:
240.2358
MDL Number:
MFCD10007821
IUPAC Name:
1,3-dimethyl-2,4-dioxothieno[2,3-d]pyrimidine-6-carboxylic acid
InChI:
InChI=1S/C9H8N2O4S/c1-10-6(12)4-3-5(8(13)14)16-7(4)11(2)9(10)15/h3H,1-2H3,(H,13,14)
InChI Key:
YSGDONMZXJIIQA-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c(s1)n(C)c(=O)n(c2=O)C
Properties
Complexity:
373  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.02g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.233g/mol
Monoisotopic Mass:
240.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties