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RyRs activator 2

CAT: 0931-T63672-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T63672-03Size:100 mg
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CAS Number
2408415-52-9
Target
Parasite, Others
Related Pathways
Others, Microbiology/Virology
Bioactivity
RyRs activator 2 is a potent activator of ranibulin receptors (RyRs) . ryRs activator 2 has a larvicidal activity of 30%, which is comparable to chlorfenvinphos (30%) and better than cyanobenzamide (10%) .
Smiles
C(NC1=C(C(NC(C)C)=O)C=C(Cl)C=C1C)(=O)C=2N(N=C(C(F)(F)F)C2)C3=CC(C#N)=CC=C3Cl
Molecular Formula
C23H18Cl2F3N5O2
Molecular Weight
524.32
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

RyRs activator 2
CAS Number2408415-52-9
PubChem CID163408857
IUPAC Name1-(2-chloro-5-cyanophenyl)-N-[4-chloro-2-methyl-6-(propan-2-ylcarbamoyl)phenyl]-3-(trifluoromethyl)pyrazole-5-carboxamide
Molecular FormulaC23H18Cl2F3N5O2
Molecular Weight524.3
XLogP5.9
Topological Polar Surface Area99.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count35
Formal Charge0
Complexity836
SMILES
CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC(=C3)C#N)Cl)C(F)(F)F)C(=O)NC(C)C)Cl
InChI
InChI=1S/C23H18Cl2F3N5O2/c1-11(2)30-21(34)15-8-14(24)6-12(3)20(15)31-22(35)18-9-19(23(26,27)28)32-33(18)17-7-13(10-29)4-5-16(17)25/h4-9,11H,1-3H3,(H,30,34)(H,31,35)
InChIKey
DXBACVIDBCHHCO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of RyRs activator 2
CAS: 2408415-52-9
CID: 163408857
Formula: C23H18Cl2F3N5O2
MW: 524.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight524.3
XLogP35.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass523.0789647
Monoisotopic Mass523.0789647
Topological Polar Surface Area99.8 Ų
Heavy Atom Count35
Formal Charge0
Complexity836
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