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DX2-201

CAT: 0013-GTR19186187-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19186187-01Size:25 mg
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Description
DX2-201 is a potent and selective complex I oxidative phosphorylation (OXPHOS) inhibitor with an IC50 of 312 nM. Its anticancer activity has been demonstrated in vitro and in vivo, making it a valuable tool for investigating cancer metabolism and mitochondrial function in research.
CAS Number
2749554-00-3
Field of Research
Cell Biology, Metabolism Research
Smiles
S (=O) (=O) (N1C[C@H] (C (OCC) =O) CCC1) C2=CC=C (S (N (CC) CC) (=O) =O) C=C2
Molecular Formula
C18H28N2O6S2
Molecular Weight
432.55
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

ethyl (3R)-1-[4-(diethylsulfamoyl)phenyl]sulfonylpiperidine-3-carboxylate
CAS Number2749554-00-3
PubChem CID1174585
IUPAC Nameethyl (3R)-1-[4-(diethylsulfamoyl)phenyl]sulfonylpiperidine-3-carboxylate
Molecular FormulaC18H28N2O6S2
Molecular Weight432.6
XLogP1.7
Topological Polar Surface Area118
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Heavy Atom Count28
Formal Charge0
Complexity714
SMILES
CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)OCC
InChI
InChI=1S/C18H28N2O6S2/c1-4-19(5-2)27(22,23)16-9-11-17(12-10-16)28(24,25)20-13-7-8-15(14-20)18(21)26-6-3/h9-12,15H,4-8,13-14H2,1-3H3/t15-/m1/s1
InChIKey
YXHKYCUPYONBDS-OAHLLOKOSA-N
Chemical Structure
2D Structure
2D structure of ethyl (3R)-1-[4-(diethylsulfamoyl)phenyl]sulfonylpiperidine-3-carboxylate
CAS: 2749554-00-3
CID: 1174585
Formula: C18H28N2O6S2
MW: 432.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight432.6
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass432.13887896
Monoisotopic Mass432.13887896
Topological Polar Surface Area118 Ų
Heavy Atom Count28
Formal Charge0
Complexity714
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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