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Indophagolin

CAT: 0013-GTR19156371-08Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156371-08Size:50 mg
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Description
Indophagolin is a potent, indoline-containing autophagy inhibitor with IC50 of 140 nM. Indophagolin antagonizes the purinergic receptor P2X4 as well as P2X1 and P2X3 with IC50s of 2.71, 2.40 and 3.49 μM, respectively.
CAS Number
1207660-00-1
Purity
>98% (HPLC)
Solubility
DMSO:10 mM
Smiles
O=S (C1=CC2=C (C=C1Br) CCN2C (C3CC3) =O) (NC4=CC=C (Cl) C (C (F) (F) F) =C4) =O
Molecular Formula
C19H15BrClF3N2O3S
Molecular Weight
523.75
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Indophagolin
CAS Number1207660-00-1
PubChem CID46504926
IUPAC Name5-bromo-N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(cyclopropanecarbonyl)-2,3-dihydroindole-6-sulfonamide
Molecular FormulaC19H15BrClF3N2O3S
Molecular Weight523.8
XLogP4.5
Topological Polar Surface Area74.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity774
SMILES
C1CC1C(=O)N2CCC3=CC(=C(C=C32)S(=O)(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F)Br
InChI
InChI=1S/C19H15BrClF3N2O3S/c20-14-7-11-5-6-26(18(27)10-1-2-10)16(11)9-17(14)30(28,29)25-12-3-4-15(21)13(8-12)19(22,23)24/h3-4,7-10,25H,1-2,5-6H2
InChIKey
OGXJZCDFFBDSJJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Indophagolin
CAS: 1207660-00-1
CID: 46504926
Formula: C19H15BrClF3N2O3S
MW: 523.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight523.8
XLogP34.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass521.96274
Monoisotopic Mass521.96274
Topological Polar Surface Area74.9 Ų
Heavy Atom Count30
Formal Charge0
Complexity774
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

Alternative Products

CatalogName
BA3666-50Indophagolin

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