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SP420

CAT: 0013-GTR19158238-05Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19158238-05Size:5 mg
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Description
SP-420 is a novel orally active iron chelator.
CAS Number
911714-45-9
Product Name Alternative
SP 420 | SP-420
Purity
>98% (HPLC)
Solubility
DMSO: 35 mg/mL (98.48 mM)
Smiles
COCCOCCOc1ccc (C2=N[C@] (C) (CS2) C (O) =O) c (O) c1
Molecular Formula
C16H21NO6S
Molecular Weight
355.41
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
(4S) -45-Dihydro-2-[2-hydroxy-4-[2- (2-methoxyethoxy) ethoxy]phenyl]-4-methyl-4-thiazolecarboxylic acid

Chemical Information

Sp-420

SP-420 is under investigation in clinical trial NCT03801889 (SP-420 in Subjects With Transfusion-dependent Beta-thalassemia or Other Rare Anemias).

CAS Number911714-45-9
PubChem CID135511704
IUPAC Name(4S)-2-[2-hydroxy-4-[2-(2-methoxyethoxy)ethoxy]phenyl]-4-methyl-5H-1,3-thiazole-4-carboxylic acid
Molecular FormulaC16H21NO6S
Molecular Weight355.4
XLogP1.3
Topological Polar Surface Area123
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Heavy Atom Count24
Formal Charge0
Complexity460
SMILES
C[C@@]1(CSC(=N1)C2=C(C=C(C=C2)OCCOCCOC)O)C(=O)O
InChI
InChI=1S/C16H21NO6S/c1-16(15(19)20)10-24-14(17-16)12-4-3-11(9-13(12)18)23-8-7-22-6-5-21-2/h3-4,9,18H,5-8,10H2,1-2H3,(H,19,20)/t16-/m1/s1
InChIKey
YASYAEVZKXPYIZ-MRXNPFEDSA-N
Chemical Structure
2D Structure
2D structure of Sp-420
CAS: 911714-45-9
CID: 135511704
Formula: C16H21NO6S
MW: 355.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight355.4
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass355.10895856
Monoisotopic Mass355.10895856
Topological Polar Surface Area123 Ų
Heavy Atom Count24
Formal Charge0
Complexity460
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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