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SX 3202

CAT: 0013-GTR19209497-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209497-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SX 3202 is a small molecule aldose reductase inhibitor under investigation for diabetic neuropathy. It is utilized in research to study polyol pathway inhibition, with applications in both in vitro enzyme assays and in vivo models of diabetic complications.
CAS Number
147254-65-7
Smiles
O=C1[C@]2 (N3C (C (=O) N1CC4=C (F) C=C (Br) C=C4) =CC=C3) CC (=O) NC2=O
Molecular Formula
C17H11BrFN3O4
Molecular Weight
420.19
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(3S)-2'-[(4-Bromo-2-fluorophenyl)methyl]spiro[pyrrolidine-3,4'-pyrrolo[1,2-A]pyrazine]-1',2,3',5-tetrone
CAS Number147254-65-7
PubChem CID10047735
IUPAC Name(3S)-2'-[(4-bromo-2-fluorophenyl)methyl]spiro[pyrrolidine-3,4'-pyrrolo[1,2-a]pyrazine]-1',2,3',5-tetrone
Molecular FormulaC17H11BrFN3O4
Molecular Weight420.2
XLogP1.3
Topological Polar Surface Area88.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count26
Formal Charge0
Complexity689
SMILES
C1C(=O)NC(=O)[C@]12C(=O)N(C(=O)C3=CC=CN23)CC4=C(C=C(C=C4)Br)F
InChI
InChI=1S/C17H11BrFN3O4/c18-10-4-3-9(11(19)6-10)8-21-14(24)12-2-1-5-22(12)17(16(21)26)7-13(23)20-15(17)25/h1-6H,7-8H2,(H,20,23,25)/t17-/m0/s1
InChIKey
QCVNMNYRNIMDKV-KRWDZBQOSA-N
Chemical Structure
2D Structure
2D structure of (3S)-2'-[(4-Bromo-2-fluorophenyl)methyl]spiro[pyrrolidine-3,4'-pyrrolo[1,2-A]pyrazine]-1',2,3',5-tetrone
CAS: 147254-65-7
CID: 10047735
Formula: C17H11BrFN3O4
MW: 420.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight420.2
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass418.99170
Monoisotopic Mass418.99170
Topological Polar Surface Area88.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity689
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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