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97195-92-1 | N1-(4-methoxyphenyl)-2-(4-pyridylcarbonyl)hydrazine-1-carbothioamide
CAS No: 97195-92-1 Catalog No: AG01CXRT MDL No:MFCD00123797
Product Description
Catalog Number:
AG01CXRT
Chemical Name:
N1-(4-methoxyphenyl)-2-(4-pyridylcarbonyl)hydrazine-1-carbothioamide
CAS Number:
97195-92-1
Molecular Formula:
C14H14N4O2S
Molecular Weight:
302.3516
MDL Number:
MFCD00123797
IUPAC Name:
1-(4-methoxyphenyl)-3-(pyridine-4-carbonylamino)thiourea
InChI:
InChI=1S/C14H14N4O2S/c1-20-12-4-2-11(3-5-12)16-14(21)18-17-13(19)10-6-8-15-9-7-10/h2-9H,1H3,(H,17,19)(H2,16,18,21)
InChI Key:
PWRQOXHJHWNPTK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=S)NNC(=O)c1ccncc1
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.084g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
302.352g/mol
Monoisotopic Mass:
302.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Synthesis and anti-Candidal activity of N-(4-aryl/cyclohexyl)-2-(pyridine-4-yl carbonyl) hydrazinecarbothioamide. | Bioorganic & medicinal chemistry letters 20140301 |
| Antimycobacterial activity of novel N-(substituted)-2-isonicotinoylhydrazinocarbothioamide endowed with high activity towards isoniazid resistant tuberculosis. | Biomedicine & pharmacotherapy = Biomedecine & pharmacotherapie 20090101 |
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