Products for Research Use Only

F8-S43-S3

CAT: 0013-GTR19187877-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19187877-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
F8-S43-S3
CAS Number
1632320-78-5
Field of Research
Immunology & Inflammation, Infectious Disease & Virology
Purity
99.69% (May vary between batches)
Smiles
NC (N/N=C/C1=CC=C (C2=CC=C (C=C2) [N+] ([O-]) =O) O1) =S
Molecular Formula
C12H10N4O3S
Molecular Weight
290.3
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(2E)-2-{[5-(4-nitrophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide
CAS Number1632320-78-5
PubChem CID6861666
IUPAC Name[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]thiourea
Molecular FormulaC12H10N4O3S
Molecular Weight290.30
XLogP2.1
Topological Polar Surface Area141
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity391
SMILES
C1=CC(=CC=C1C2=CC=C(O2)/C=N/NC(=S)N)[N+](=O)[O-]
InChI
InChI=1S/C12H10N4O3S/c13-12(20)15-14-7-10-5-6-11(19-10)8-1-3-9(4-2-8)16(17)18/h1-7H,(H3,13,15,20)/b14-7+
InChIKey
AZTASKRPWMAJOD-VGOFMYFVSA-N
Chemical Structure
2D Structure
2D structure of (2E)-2-{[5-(4-nitrophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide
CAS: 1632320-78-5
CID: 6861666
Formula: C12H10N4O3S
MW: 290.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight290.30
XLogP32.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass290.04736137
Monoisotopic Mass290.04736137
Topological Polar Surface Area141 Ų
Heavy Atom Count20
Formal Charge0
Complexity391
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