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Deferitazole

CAT: 0931-T31362-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T31362-05Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
945635-15-4
Target
Others, Parasite, Ferroptosis
Related Pathways
Microbiology/Virology, Others, Apoptosis
Purity
0.9948
Bioactivity
Deferitazole (FBS 0701) is a novel and orally active, selective and high affinity iron chelator.
Smiles
OC1=C(C2=N[C@](C(O)=O)(C)CS2)C=CC=C1OCCOCCOCCOC
Molecular Formula
C18H25NO7S
Molecular Weight
399.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Deferitazole

Deferitazole is an iron chelator. It has been used in trials studying the treatment and basic science of Beta-thalassemia, Hepatic Impairment, Impaired Renal Function, Transfusional Iron Overload, and Iron Overload Due to Repeated Red Blood Cell Transfusions.

CAS Number945635-15-4
PubChem CID135565672
IUPAC Name(4S)-2-[2-hydroxy-3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-4-methyl-5H-1,3-thiazole-4-carboxylic acid
Molecular FormulaC18H25NO7S
Molecular Weight399.5
XLogP1.2
Topological Polar Surface Area132
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count12
Heavy Atom Count27
Formal Charge0
Complexity504
SMILES
C[C@@]1(CSC(=N1)C2=C(C(=CC=C2)OCCOCCOCCOC)O)C(=O)O
InChI
InChI=1S/C18H25NO7S/c1-18(17(21)22)12-27-16(19-18)13-4-3-5-14(15(13)20)26-11-10-25-9-8-24-7-6-23-2/h3-5,20H,6-12H2,1-2H3,(H,21,22)/t18-/m1/s1
InChIKey
AWHIMFSHNAAMBM-GOSISDBHSA-N
Chemical Structure
2D Structure
2D structure of Deferitazole
CAS: 945635-15-4
CID: 135565672
Formula: C18H25NO7S
MW: 399.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight399.5
XLogP31.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count12
Exact Mass399.13517331
Monoisotopic Mass399.13517331
Topological Polar Surface Area132 Ų
Heavy Atom Count27
Formal Charge0
Complexity504
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

Alternative Products

CatalogName
HY-101672-01Deferitazole
MBS5780982Deferitazole magnesuM
GTR19194750Deferitazole magnesium

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