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Home > Pyridines > 850628-76-1
850628-76-1 | 5-Methyl-2-(Methylthio)pyrido[2,3-d]pyriMidin-7(8H)-one
CAS No: 850628-76-1 Catalog No: AG00GLWA MDL No:MFCD19980621
Product Description
Catalog Number:
AG00GLWA
Chemical Name:
5-Methyl-2-(Methylthio)pyrido[2,3-d]pyriMidin-7(8H)-one
CAS Number:
850628-76-1
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
MDL Number:
MFCD19980621
IUPAC Name:
5-methyl-2-methylsulfanyl-8H-pyrido[2,3-d]pyrimidin-7-one
InChI:
InChI=1S/C9H9N3OS/c1-5-3-7(13)11-8-6(5)4-10-9(12-8)14-2/h3-4H,1-2H3,(H,10,11,12,13)
InChI Key:
PDPYQIHQFJOCBV-UHFFFAOYSA-N
SMILES:
CSc1ncc2c(n1)[nH]c(=O)cc2C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.251g/mol
Monoisotopic Mass:
207.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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