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CTPI-2

CAT: 1568-C09002-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1568-C09002-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
68003-38-3
SKU
C09002-5mg
Target
Mitochondrial Metabolism
Applications
Metabolism
Smiles
OC (=O) C1=CC=CC=C1N[S] (=O) (=O) C2=CC (=C (Cl) C=C2) [N+] ([O-]) =O
Molecular Formula
C13H9ClN2O6S
Additionnal Information
CTPI-2 is an inhibitor of mitochondrial citrate carrier SLC25A1 with KD of 3.5 μM. CTPI-2 is a unique regulator of glycolysis that limits the metabolic plasticity of cancer stem cells (CSCs) .
Storage Conditions
3 years -20°C powder

Chemical Information

2-((4-Chloro-3-nitrophenyl)sulfonyl)anthranilic acid
CAS Number68003-38-3
PubChem CID106350
IUPAC Name2-[(4-chloro-3-nitrophenyl)sulfonylamino]benzoic acid
Molecular FormulaC13H9ClN2O6S
Molecular Weight356.74
XLogP3
Topological Polar Surface Area138
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity558
SMILES
C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]
InChI
InChI=1S/C13H9ClN2O6S/c14-10-6-5-8(7-12(10)16(19)20)23(21,22)15-11-4-2-1-3-9(11)13(17)18/h1-7,15H,(H,17,18)
InChIKey
NJTHPOSQGFJTDP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((4-Chloro-3-nitrophenyl)sulfonyl)anthranilic acid
CAS: 68003-38-3
CID: 106350
Formula: C13H9ClN2O6S
MW: 356.74
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight356.74
XLogP33
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass355.9869849
Monoisotopic Mass355.9869849
Topological Polar Surface Area138 Ų
Heavy Atom Count23
Formal Charge0
Complexity558
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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