Products for Research Use Only

JNJ0966

CAT: 0013-GTR19168396-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19168396-04Size:10 mg
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Description
JNJ0966 is a potent and selective small molecule inhibitor of matrix metalloproteinase-9 (MMP-9) proenzyme, exhibiting an IC50 of 440 nM. It is a valuable research tool for studying MMP-9's role in inflammatory, oncological, and neurological diseases in both cellular and animal models.
CAS Number
315705-75-0
Product Name Alternative
Inhibitor, inhibit, JNJ0966, JNJ-0966, JNJ 0966, MMP-9, MMP, Matrix metalloproteinases
Field of Research
Protein Biochemistry
Purity
99.46% (May vary between batches)
Solubility
DMSO:150 mg/mL (416.15 mM) ;10% DMSO+90% Corn Oil:3.3 mg/mL (9.16 mM)
Smiles
COc1ccccc1Nc1nc (cs1) -c1sc (NC (C) =O) nc1C
Molecular Formula
C16H16N4O2S2
Molecular Weight
360.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(2-((2-methoxyphenyl)amino)-4'-methyl-[4,5'-bithiazol]-2'-yl)acetamide
CAS Number315705-75-0
PubChem CID1117189
IUPAC NameN-[5-[2-(2-methoxyanilino)-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
Molecular FormulaC16H16N4O2S2
Molecular Weight360.5
XLogP3.4
Topological Polar Surface Area133
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity442
SMILES
CC1=C(SC(=N1)NC(=O)C)C2=CSC(=N2)NC3=CC=CC=C3OC
InChI
InChI=1S/C16H16N4O2S2/c1-9-14(24-16(17-9)18-10(2)21)12-8-23-15(20-12)19-11-6-4-5-7-13(11)22-3/h4-8H,1-3H3,(H,19,20)(H,17,18,21)
InChIKey
ZADCDCMLLGDCRM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-((2-methoxyphenyl)amino)-4'-methyl-[4,5'-bithiazol]-2'-yl)acetamide
CAS: 315705-75-0
CID: 1117189
Formula: C16H16N4O2S2
MW: 360.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight360.5
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass360.07146811
Monoisotopic Mass360.07146811
Topological Polar Surface Area133 Ų
Heavy Atom Count24
Formal Charge0
Complexity442
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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