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AT-130

CAT: 0013-GTR19174773-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19174773-04Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
AT-130
CAS Number
211364-06-6
Product Name Alternative
RtL180M, rtM204I, RNA Synthesis, RNASynthesis, RNA, inhibit, Hepatitis B virus, HepG2, HBV, Inhibitor, Huh-7, AT 130, AT130, AT-130, core, DNASynthesis, DNA Synthesis, DNA/RNA Synthesis
Field of Research
Cell Biology, Infectious Disease & Virology, Molecular Biology
Purity
97.81% (May vary between batches)
Solubility
10% DMSO+90% Corn Oil:2 mg/mL (4.1 mM) ; DMSO:23 mg/mL (47.1 mM)
Smiles
COc1ccccc1\C (Br) =C (/NC (=O) c1ccc (cc1) [N+] ([O-]) =O) C (=O) N1CCCCC1
Molecular Formula
C22H22BrN3O5
Molecular Weight
488.33
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[(1e)-1-Bromo-1-(2-Methoxyphenyl)-3-Oxo-3-(Piperidin-1-Yl)prop-1-En-2-Yl]-4-Nitrobenzamide
CAS Number211364-06-6
PubChem CID3002812
IUPAC NameN-[(E)-1-bromo-1-(2-methoxyphenyl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]-4-nitrobenzamide
Molecular FormulaC22H22BrN3O5
Molecular Weight488.3
XLogP4
Topological Polar Surface Area104
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity694
SMILES
COC1=CC=CC=C1/C(=C(/C(=O)N2CCCCC2)\NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])/Br
InChI
InChI=1S/C22H22BrN3O5/c1-31-18-8-4-3-7-17(18)19(23)20(22(28)25-13-5-2-6-14-25)24-21(27)15-9-11-16(12-10-15)26(29)30/h3-4,7-12H,2,5-6,13-14H2,1H3,(H,24,27)/b20-19+
InChIKey
OQIUTYABZMBBME-FMQUCBEESA-N
Chemical Structure
2D Structure
2D structure of N-[(1e)-1-Bromo-1-(2-Methoxyphenyl)-3-Oxo-3-(Piperidin-1-Yl)prop-1-En-2-Yl]-4-Nitrobenzamide
CAS: 211364-06-6
CID: 3002812
Formula: C22H22BrN3O5
MW: 488.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight488.3
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass487.07428
Monoisotopic Mass487.07428
Topological Polar Surface Area104 Ų
Heavy Atom Count31
Formal Charge0
Complexity694
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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