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Fidarestat

CAT: 0931-T15281-04Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T15281-04Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
136087-85-9
Target
Reductase
Related Pathways
Endocrinology/Hormones, Metabolism
Bioactivity
Fidarestat (SNK 860), an aldose reductase inhibitor, exhibits IC50 values of 26 nM, 33 μM, and 1.8 μM against aldose reductase, AKR1B10, and V301L AKR1B10 respectively, demonstrating potential for diabetes treatment.
Smiles
O=C1[C@]2(C=3C(O[C@H](C(N)=O)C2)=CC=C(F)C3)NC(=O)N1
Molecular Formula
C12H10FN3O4
Molecular Weight
279.22
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Fidarestat

structure given in first source

CAS Number136087-85-9
PubChem CID160024
IUPAC Name(2S,4S)-6-fluoro-2',5'-dioxospiro[2,3-dihydrochromene-4,4'-imidazolidine]-2-carboxamide
Molecular FormulaC12H10FN3O4
Molecular Weight279.22
XLogP-0.3
Topological Polar Surface Area111
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity485
SMILES
C1[C@H](OC2=C([C@]13C(=O)NC(=O)N3)C=C(C=C2)F)C(=O)N
InChI
InChI=1S/C12H10FN3O4/c13-5-1-2-7-6(3-5)12(4-8(20-7)9(14)17)10(18)15-11(19)16-12/h1-3,8H,4H2,(H2,14,17)(H2,15,16,18,19)/t8-,12-/m0/s1
InChIKey
WAAPEIZFCHNLKK-UFBFGSQYSA-N
Chemical Structure
2D Structure
2D structure of Fidarestat
CAS: 136087-85-9
CID: 160024
Formula: C12H10FN3O4
MW: 279.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight279.22
XLogP3-0.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass279.06553397
Monoisotopic Mass279.06553397
Topological Polar Surface Area111 Ų
Heavy Atom Count20
Formal Charge0
Complexity485
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
BA7152-5Fidarestat
AR-F01417-01Fidarestat-d3
HY-105185B(Rac) -Fidarestat
AR-F01416-01Fidarestat (SNK 860)
MBS386928-01Fidarestat (SNK-860)
A11790-1Fidarestat (SNK-860) 1mg
A11790-10Fidarestat (SNK-860) 10mg
A11790-5Fidarestat (SNK-860) 5mg

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