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CLP257

CAT: 1410-M10616-01Size: 1 EachDry Ice: NoHazardous: No
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Description
CLP257 (CLP-257) is a potent, selective K+-Cl- cotransporter KCC2 activator with EC50 of 616 nM.
CAS Number
1181081-71-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
307.34
Molecular Formula
C14H14FN3O2S
Notes
Research use only, not for human use.
Receptor
Chloride Channel

Chemical Information

Clp257

a chloride extrusion enhancer that targets KCC2; structure in first source

CAS Number1181081-71-9
PubChem CID44188931
IUPAC Name(5Z)-2-(diazinan-1-yl)-5-[(4-fluoro-2-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
Molecular FormulaC14H14FN3O2S
Molecular Weight307.35
XLogP2.5
Topological Polar Surface Area90.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity483
SMILES
C1CCN(NC1)C2=NC(=O)/C(=C/C3=C(C=C(C=C3)F)O)/S2
InChI
InChI=1S/C14H14FN3O2S/c15-10-4-3-9(11(19)8-10)7-12-13(20)17-14(21-12)18-6-2-1-5-16-18/h3-4,7-8,16,19H,1-2,5-6H2/b12-7-
InChIKey
SKCADXVKQRCWTR-GHXNOFRVSA-N
Chemical Structure
2D Structure
2D structure of Clp257
CAS: 1181081-71-9
CID: 44188931
Formula: C14H14FN3O2S
MW: 307.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight307.35
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass307.07907603
Monoisotopic Mass307.07907603
Topological Polar Surface Area90.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity483
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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CatalogName
MBS5768908CLP257

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