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Aspergillus niger-IN-1

CAT: 0804-HY-131050Size: 1 EachDry Ice: NoHazardous: No
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Description
Aspergillus niger-IN-1 (Compound 17), a derivative of thiazolidine-2,4-dione, acts as an antimicrobial agent. Aspergillus niger-IN-1 exhibited antimicrobial activity against various bacterial and fungal strains, including Bacillus subtilis, Staphylococcus aureus, Klebsiella pneumonia, Escherichia coli, Salmonella typhi, Candida albicans and Aspergillus niger, with MIC values of 11.3, 5.65, 11.3, 5.65, 5.65, 5.65, and 5.65 μM/mL, respectively [1].
CAS Number
6325-94-6
UNSPSC
12352005
Hazard Statement
H319
Target
Bacterial; Fungal
Related Pathways
Anti-infection
Field of Research
Infection
Smiles
O=C(NC/1=O)SC1=C/C2=CC=CC=C2O
Molecular Formula
C10H7NO3S
Molecular Weight
221.23
Precautions
P264-P280-P305+P351+P338
References & Citations
[1]Sucheta, et al. Synthesis, SAR and in vitro therapeutic potentials of thiazolidine-2,4-diones. Chem Cent J. 2018 Dec 4;12 (1) :129.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

5-(2-Hydroxybenzylidene)thiazolidine-2,4-dione

See also: 5-(2-Hydroxy-benzylidene)-thiazolidine-2,4-dione (annotation moved to).

CAS Number6325-94-6
PubChem CID6070143
IUPAC Name(5Z)-5-[(2-hydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
Molecular FormulaC10H7NO3S
Molecular Weight221.23
XLogP1.8
Topological Polar Surface Area91.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity327
SMILES
C1=CC=C(C(=C1)/C=C\2/C(=O)NC(=O)S2)O
InChI
InChI=1S/C10H7NO3S/c12-7-4-2-1-3-6(7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14)/b8-5-
InChIKey
IZVVCHFDGJEVTB-YVMONPNESA-N
Chemical Structure
2D Structure
2D structure of 5-(2-Hydroxybenzylidene)thiazolidine-2,4-dione
CAS: 6325-94-6
CID: 6070143
Formula: C10H7NO3S
MW: 221.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight221.23
XLogP31.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass221.01466426
Monoisotopic Mass221.01466426
Topological Polar Surface Area91.7 Ų
Heavy Atom Count15
Formal Charge0
Complexity327
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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