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Dynapyrazole A

CAT: 1410-M34768-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M34768-04Size:25 mg
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Description
Dynapyrazole A is a specific inhibitor of microtubule dynamin with IC50s of 2.3 and 2.6 μM for dynein 1 and dynein 2-dependent microtubule gliding, and it inhibits Hedgehog signaling with an IC50 of 1.9 μM.
CAS Number
2226517-75-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
486.69
Molecular Formula
C20H12ClIN4O
Notes
Research use only, not for human use.
Receptor
Dynamin

Chemical Information

Dynapyrazole A
CAS Number2226517-75-3
PubChem CID136213044
IUPAC Name2-[1-(4-chlorophenyl)cyclopropyl]-7-iodo-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carbonitrile
Molecular FormulaC20H12ClIN4O
Molecular Weight486.7
XLogP4.4
Topological Polar Surface Area70.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count27
Formal Charge0
Complexity668
SMILES
C1CC1(C2=CC=C(C=C2)Cl)C3=NN4C5=C(C=C(C=C5)I)C(=O)NC4=C3C#N
InChI
InChI=1S/C20H12ClIN4O/c21-12-3-1-11(2-4-12)20(7-8-20)17-15(10-23)18-24-19(27)14-9-13(22)5-6-16(14)26(18)25-17/h1-6,9H,7-8H2,(H,24,27)
InChIKey
VABPBCMFKJDOHP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dynapyrazole A
CAS: 2226517-75-3
CID: 136213044
Formula: C20H12ClIN4O
MW: 486.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight486.7
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass485.97444
Monoisotopic Mass485.97444
Topological Polar Surface Area70.7 Ų
Heavy Atom Count27
Formal Charge0
Complexity668
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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