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Home > Pyridines > 211244-81-4
211244-81-4 | Pyrido[2,3-d]pyrimidin-7(8H)-one, 2-(methylthio)-
CAS No: 211244-81-4 Catalog No: AG002L92 MDL No:MFCD03084167
Product Description
Catalog Number:
AG002L92
Chemical Name:
Pyrido[2,3-d]pyrimidin-7(8H)-one, 2-(methylthio)-
CAS Number:
211244-81-4
Molecular Formula:
C8H7N3OS
Molecular Weight:
193.2257
MDL Number:
MFCD03084167
IUPAC Name:
2-methylsulfanyl-8H-pyrido[2,3-d]pyrimidin-7-one
InChI:
InChI=1S/C8H7N3OS/c1-13-8-9-4-5-2-3-6(12)10-7(5)11-8/h2-4H,1H3,(H,9,10,11,12)
InChI Key:
WPUAPGRZGJOIBX-UHFFFAOYSA-N
SMILES:
CSc1nc2[nH]c(=O)ccc2cn1
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.031g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.224g/mol
Monoisotopic Mass:
193.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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