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Home > Pyridines > 384342-02-3
384342-02-3 | 2-MERCAPTO-1,5,7-TRIMETHYLPYRIDO[2,3-D]PYRIMIDIN-4(1H)-ONE
CAS No: 384342-02-3 Catalog No: AG01AO8S MDL No:MFCD08555653
Product Description
Catalog Number:
AG01AO8S
Chemical Name:
2-MERCAPTO-1,5,7-TRIMETHYLPYRIDO[2,3-D]PYRIMIDIN-4(1H)-ONE
CAS Number:
384342-02-3
Molecular Formula:
C10H11N3OS
Molecular Weight:
221.2788
MDL Number:
MFCD08555653
IUPAC Name:
1,5,7-trimethyl-2-sulfanylidenepyrido[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C10H11N3OS/c1-5-4-6(2)11-8-7(5)9(14)12-10(15)13(8)3/h4H,1-3H3,(H,12,14,15)
InChI Key:
CLNUGICORCVFAB-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c2c(n1)n(C)c(nc2=O)S
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.062g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.278g/mol
Monoisotopic Mass:
221.062g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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