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63698-06-6 | 2-Acetylpyridine-(4-phenylthiosemicarbazone)
CAS No: 63698-06-6 Catalog No: AG00EMS2 MDL No:
Product Description
Catalog Number:
AG00EMS2
Chemical Name:
2-Acetylpyridine-(4-phenylthiosemicarbazone)
CAS Number:
63698-06-6
IUPAC Name:
1-phenyl-3-[(E)-1-pyridin-2-ylethylideneamino]thiourea
InChI:
InChI=1S/C14H14N4S/c1-11(13-9-5-6-10-15-13)17-18-14(19)16-12-7-3-2-4-8-12/h2-10H,1H3,(H2,16,18,19)/b17-11+
InChI Key:
VHVSCHSQNUUXNS-GZTJUZNOSA-N
NSC Number:
291330
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
270.094g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
270.354g/mol
Monoisotopic Mass:
270.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| N⁴-Phenyl-substituted 2-acetylpyridine thiosemicarbazones: cytotoxicity against human tumor cells, structure-activity relationship studies and investigation on the mechanism of action. | Bioorganic & medicinal chemistry 20120601 |
| Thiosemicarbazones, semicarbazones, dithiocarbazates and hydrazide/hydrazones: anti-Mycobacterium tuberculosis activity and cytotoxicity. | European journal of medicinal chemistry 20100501 |
| 2-Acetylpyridine thiosemicarbazones are potent iron chelators and antiproliferative agents: redox activity, iron complexation and characterization of their antitumor activity. | Journal of medicinal chemistry 20090312 |
| Antifungal and antibacterial activity of 2-acetylpyridine-(4-phenylthiosemicarbazone) and its metal (II) complexes. | Farmaco (Societa chimica italiana : 1989) 19921201 |
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