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T16Ainh-A01 (Standard)

CAT: 0804-HY-100612RSize: 1 EachDry Ice: NoHazardous: No
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Description
T16Ainh-A01 (Standard) is the analytical standard of T16Ainh-A01. This product is intended for research and analytical applications. T16Ainh-A01, an aminophenylthiazole, is a potent transmembrane protein 16A (TMEM16A) inhibitor, inhibiting TMEM16A-mediated chloride currents with an IC50 value of ~1 μM. TMEM16A (ANO1) functions as a calcium-activated chloride channel (CaCC)[2].
CAS Number
552309-42-9
Target
Chloride Channel; Reference Standards
Related Pathways
Membrane Transporter/Ion Channel; Others
Field of Research
Others
Smiles
O=C(NC1=NC(C2=CC=C(OC)C=C2)=CS1)CSC3=NC(C)=C(CC)C(N3)=O
Molecular Formula
C19H20N4O3S2
Molecular Weight
416.52
References & Citations
[1]Fedigan S, et al. Effects of new-generation TMEM16A inhibitors on calcium-activated chloride currents in rabbit urethral interstitial cells of Cajal. Pflugers Arch. 2017 Nov;469 (11) :1443-1455.|[2]Namkung W, et al. TMEM16A inhibitors reveal TMEM16A as a minor component of calcium-activated chloride channel conductance in airway and intestinal epithelial cells. J Biol Chem. 2011 Jan 21;286 (3) :2365-74.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

T16AInh-A01
CAS Number552309-42-9
PubChem CID135460621
IUPAC Name2-[(5-ethyl-4-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acetamide
Molecular FormulaC19H20N4O3S2
Molecular Weight416.5
XLogP3.3
Topological Polar Surface Area146
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity660
SMILES
CCC1=C(N=C(NC1=O)SCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)OC)C
InChI
InChI=1S/C19H20N4O3S2/c1-4-14-11(2)20-18(23-17(14)25)28-10-16(24)22-19-21-15(9-27-19)12-5-7-13(26-3)8-6-12/h5-9H,4,10H2,1-3H3,(H,20,23,25)(H,21,22,24)
InChIKey
QSIYTNYMBWYHAA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of T16AInh-A01
CAS: 552309-42-9
CID: 135460621
Formula: C19H20N4O3S2
MW: 416.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight416.5
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass416.09768286
Monoisotopic Mass416.09768286
Topological Polar Surface Area146 Ų
Heavy Atom Count28
Formal Charge0
Complexity660
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
256793-01T16Ainh - A01
bs-6982C-01T16Ainh-A01
A15470-10T16Ainh-A01 10mg
A15470-50T16Ainh-A01 50mg
A15470-200T16Ainh-A01 200mg
A15470-25T16Ainh-A01 25mg
A15470-100T16Ainh-A01 100mg
A15470-5T16Ainh-A01 5mg
CXA30942-01TMEM16A Inhibitor, T16Ainh-A01
217840TMEM16A Inhibitor, T16Ainh-A01 (2- (5-ethyl-4-hydroxy-6-methylpyrimidin-2-ylthio) -N- (4- (4-methoxyphenyl) thiazol-2-yl) acetamide, ANO1 Inhibitor, T16Ainh-A01, TMEM16A Antagonist, T16Ainh-A01)

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