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79246-92-7 | 2(1H)-Pyridinethione,3-hydroxy-1-methyl-(9CI)
CAS No: 79246-92-7 Catalog No: AG00GE5F MDL No:
Product Description
Catalog Number:
AG00GE5F
Chemical Name:
2(1H)-Pyridinethione,3-hydroxy-1-methyl-(9CI)
CAS Number:
79246-92-7
IUPAC Name:
3-hydroxy-1-methylpyridine-2-thione
InChI:
InChI=1S/C6H7NOS/c1-7-4-2-3-5(8)6(7)9/h2-4,8H,1H3
InChI Key:
SQEXIHSVVCJZTQ-UHFFFAOYSA-N
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
141.188g/mol
Monoisotopic Mass:
141.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Identifying chelators for metalloprotein inhibitors using a fragment-based approach. | Journal of medicinal chemistry 20110127 |
| Synthesis and characterization of Fe(III) and Pb(ll) complexes with 3-hydroxypyridine-2(1H)-thiones. | Hemoglobin 20060101 |
| Synthesis, structure and spectroscopy of new thiopyrone and hydroxypyridinethione transition-metal complexes. | Dalton transactions (Cambridge, England : 2003) 20050807 |
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