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Kinesore

CAT: 0804-HY-112777-02Size: 10 mM - 1 mLDry Ice: NoHazardous: No
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CAT#:0804-HY-112777-02Size:10 mM - 1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Kinesore is an inhibitor of the KLC2-SKIP Interaction.
CAS Number
363571-83-9
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Kinesin; Microtubule/Tubulin
Type
Reference compound
Related Pathways
Cell Cycle/DNA Damage; Cytoskeleton
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/Kinesore.html
Purity
98.0
Solubility
DMSO : 125 mg/mL (ultrasonic)
Smiles
O=C(N/N=C/C1=C(C)N(C2=CC=CC([N+]([O-])=O)=C2)C(C)=C1)C3=CC(Br)=C(O)C(Br)=C3
Molecular Formula
C20H16Br2N4O4
Molecular Weight
536.17
Precautions
H302, H315, H319, H335
References & Citations
[1]Randall TS, et al. A small-molecule activator of kinesin-1 drives remodeling of the microtubule network. Proc Natl Acad Sci U S A. 2017 Dec 26;114 (52) :13738-13743.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

3,5-dibromo-N'-((E)-(2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl)methylidene)-4-hydroxybenzohydrazide

3,5-Dibromo-N'-((2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl)methylene)-4-hydroxybenzohydrazide is kinesin-1 modulator.

CAS Number363571-83-9
PubChem CID5349470
IUPAC Name3,5-dibromo-N-[(E)-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylideneamino]-4-hydroxybenzamide
Molecular FormulaC20H16Br2N4O4
Molecular Weight536.2
XLogP4.9
Topological Polar Surface Area112
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity649
SMILES
CC1=CC(=C(N1C2=CC(=CC=C2)[N+](=O)[O-])C)/C=N/NC(=O)C3=CC(=C(C(=C3)Br)O)Br
InChI
InChI=1S/C20H16Br2N4O4/c1-11-6-14(12(2)25(11)15-4-3-5-16(9-15)26(29)30)10-23-24-20(28)13-7-17(21)19(27)18(22)8-13/h3-10,27H,1-2H3,(H,24,28)/b23-10+
InChIKey
DUGCMEGLYHBMAR-AUEPDCJTSA-N
Chemical Structure
2D Structure
2D structure of 3,5-dibromo-N'-((E)-(2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl)methylidene)-4-hydroxybenzohydrazide
CAS: 363571-83-9
CID: 5349470
Formula: C20H16Br2N4O4
MW: 536.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight536.2
XLogP34.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass535.95178
Monoisotopic Mass533.95383
Topological Polar Surface Area112 Ų
Heavy Atom Count30
Formal Charge0
Complexity649
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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