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CBS1117

CAT: 0931-T8793-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T8793-06Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
959245-08-0
Target
Influenza Virus
Related Pathways
Microbiology/Virology
Purity
>99.99%
Bioactivity
CBS1117 is a virus entry inhibitor with an IC50 of 70 nM for influenza A virus, A/Puerto Rico/8/34 (H1N1) . It interferes with the hemagglutinin (HA) -mediated fusion process.
Smiles
CC(C)N1CCC(CC1)NC(=O)c1c(Cl)cccc1Cl
Molecular Formula
C15H20Cl2N2O
Molecular Weight
315.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2,6-Dichloro-N-[1-(1-methylethyl)-4-piperidinyl]benzamide
CAS Number959245-08-0
PubChem CID25236799
IUPAC Name2,6-dichloro-N-(1-propan-2-ylpiperidin-4-yl)benzamide
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.2
XLogP3.8
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity320
SMILES
CC(C)N1CCC(CC1)NC(=O)C2=C(C=CC=C2Cl)Cl
InChI
InChI=1S/C15H20Cl2N2O/c1-10(2)19-8-6-11(7-9-19)18-15(20)14-12(16)4-3-5-13(14)17/h3-5,10-11H,6-9H2,1-2H3,(H,18,20)
InChIKey
OUZZSIOQTSNTTI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,6-Dichloro-N-[1-(1-methylethyl)-4-piperidinyl]benzamide
CAS: 959245-08-0
CID: 25236799
Formula: C15H20Cl2N2O
MW: 315.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.2
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass314.0952687
Monoisotopic Mass314.0952687
Topological Polar Surface Area32.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity320
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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