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CHIKV-IN-2

CAT: 1410-M28655-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M28655-02Size:1 mL x 10 mM in DMSO
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CHIKV-IN-2 shows inhibitory activity against a cellular target Dihydroorotate Dehydrogenase (DHODH), which interacts with various viruses and regulate their replication via depleting intracellular pyrimidine pools.
CAS Number
2361289-44-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
362.46
Molecular Formula
C23H26N2O2
Notes
Research use only, not for human use.
Receptor
NAE

Chemical Information

Chikv-IN-2
CAS Number2361289-44-1
PubChem CID142616713
IUPAC NameN-[4-(2-cyanopropan-2-yl)phenyl]-3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulene-2-carboxamide
Molecular FormulaC23H26N2O2
Molecular Weight362.5
XLogP5.2
Topological Polar Surface Area62.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity556
SMILES
CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=C(C=C3CCCCCC3=C2)OC
InChI
InChI=1S/C23H26N2O2/c1-23(2,15-24)18-9-11-19(12-10-18)25-22(26)20-13-16-7-5-4-6-8-17(16)14-21(20)27-3/h9-14H,4-8H2,1-3H3,(H,25,26)
InChIKey
WAOHPFHXTKBTTG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chikv-IN-2
CAS: 2361289-44-1
CID: 142616713
Formula: C23H26N2O2
MW: 362.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight362.5
XLogP35.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass362.199428076
Monoisotopic Mass362.199428076
Topological Polar Surface Area62.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity556
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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Alternative Products

CatalogName
MBS3617179-01CHIKV-IN-2
470489Chikungunya (CHIKV-Env 2)
GTR19264041-01CHIKV nsP2 protease-IN-2
P523334CHIKV-E2 Protein (C-cleavage, CHIKV)
chi-003CHIKV E2
HY-169429CHIKV-IN-5
HY-163088CHIKV-IN-4
MBS5804376CHIKV-IN-3
chi-005CHIKV Capsid

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