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2302-93-4

2302-93-4 | Hydrazinecarbothioamide, 2-(1-phenylethylidene)-

CAS No: 2302-93-4 Catalog No: AG002LWE MDL No:

Product Description

Catalog Number:
AG002LWE
Chemical Name:
Hydrazinecarbothioamide, 2-(1-phenylethylidene)-
CAS Number:
2302-93-4
Molecular Formula:
C9H11N3S
Molecular Weight:
193.2687
IUPAC Name:
[(E)-1-phenylethylideneamino]thiourea
InChI:
InChI=1S/C9H11N3S/c1-7(11-12-9(10)13)8-5-3-2-4-6-8/h2-6H,1H3,(H3,10,12,13)/b11-7+
InChI Key:
JMULZUQMMLAALR-YRNVUSSQSA-N
SMILES:
CC(=NNC(=S)N)c1ccccc1
NSC Number:
713

Properties

Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
193.067g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.268g/mol
Monoisotopic Mass:
193.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Literature

Title Journal
Ketonethiosemicarbazones: structure-activity relationships for their melanogenesis inhibition. Bioorganic & medicinal chemistry letters 20110615
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
The use of microarray analysis to determine the gene expression profiles of Mycobacterium tuberculosis in response to anti-bacterial compounds. Tuberculosis (Edinburgh, Scotland) 20040101

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