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Home Other Building Blocks PYRIDINE-3-CARBOXALDEHYDE THIOSEMICARBAZONE

PYRIDINE-3-CARBOXALDEHYDE THIOSEMICARBAZONE

CAS No.:
555-90-8
Catalog Number:
AG00D8HF
Molecular Formula:
C7H8N4S
Molecular Weight:
180.2302
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Product Description
Catalog Number:
AG00D8HF
Chemical Name:
PYRIDINE-3-CARBOXALDEHYDE THIOSEMICARBAZONE
CAS Number:
555-90-8
Molecular Formula:
C7H8N4S
Molecular Weight:
180.2302
MDL Number:
MFCD00014637
IUPAC Name:
[(E)-pyridin-3-ylmethylideneamino]thiourea
InChI:
InChI=1S/C7H8N4S/c8-7(12)11-10-5-6-2-1-3-9-4-6/h1-5H,(H3,8,11,12)/b10-5+
InChI Key:
ABWLRVJYVVQTGQ-BJMVGYQFSA-N
SMILES:
NC(=S)N/N=C/c1cccnc1
EC Number:
209-108-4
UNII:
2MR9VJF32M
NSC Number:
730
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
180.047g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
180.229g/mol
Monoisotopic Mass:
180.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
EthA, a common activator of thiocarbamide-containing drugs acting on different mycobacterial targets. Antimicrobial agents and chemotherapy 20070301
SRI-286, a thiosemicarbazole, in combination with mefloquine and moxifloxacin for treatment of murine Mycobacterium avium complex disease. Antimicrobial agents and chemotherapy 20040901
Thiosemicarbazole (thiacetazone-like) compound with activity against Mycobacterium avium in mice. Antimicrobial agents and chemotherapy 20030801
Inactivation of herpes simplex virus by thiosemicarbazones and certain cations. Antimicrobial agents and chemotherapy 19740401
Properties