Home Carboxys Pyrido[2,3-d]pyrimidine-6-carboxylic acid,1,5-dihydro-2-(methylthio)-5-oxo-, ethyl ester

Pyrido[2,3-d]pyrimidine-6-carboxylic acid,1,5-dihydro-2-(methylthio)-5-oxo-, ethyl ester

CAS No.:
34711-92-7
Catalog Number:
AG00I6VA
Molecular Formula:
C11H11N3O3S
Molecular Weight:
265.2883
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Product Description
Catalog Number:
AG00I6VA
Chemical Name:
Pyrido[2,3-d]pyrimidine-6-carboxylic acid,1,5-dihydro-2-(methylthio)-5-oxo-, ethyl ester
CAS Number:
34711-92-7
Molecular Formula:
C11H11N3O3S
Molecular Weight:
265.2883
MDL Number:
MFCD19303676
IUPAC Name:
ethyl 2-methylsulfanyl-5-oxo-8H-pyrido[2,3-d]pyrimidine-6-carboxylate
InChI:
InChI=1S/C11H11N3O3S/c1-3-17-10(16)7-5-12-9-6(8(7)15)4-13-11(14-9)18-2/h4-5H,3H2,1-2H3,(H,12,13,14,15)
InChI Key:
MRVUFRQGWKYVCY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc2c(c1=O)cnc([nH]2)SC
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.052g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
265.287g/mol
Monoisotopic Mass:
265.052g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties