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FRM-024

CAT: 0013-GTR19189433Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19189433Size:5 mg
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Description
FRM-024 is a potent, CNS-penetrant gamma secretase modulator developed for familial Alzheimer's disease research. It is utilized in both in vitro and in vivo studies to investigate amyloid-beta pathology and potential therapeutic mechanisms.
CAS Number
2085780-87-4
Field of Research
Neuroscience, Protein Biochemistry, Stem Cell & Developmental Biology
Smiles
COc1nc (ccc1-n1cnc (C) c1) C1=NOC (C2CC2) [C@@H] (N1) c1ccc (Cl) cc1 |t:16, @:18|
Molecular Formula
C22H22ClN5O2
Molecular Weight
423.9
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(5R,6S)-5-(4-chlorophenyl)-6-cyclopropyl-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
CAS Number2085780-87-4
PubChem CID126599752
IUPAC Name(5R,6S)-5-(4-chlorophenyl)-6-cyclopropyl-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
Molecular FormulaC22H22ClN5O2
Molecular Weight423.9
XLogP3.8
Topological Polar Surface Area73.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity625
SMILES
CC1=CN(C=N1)C2=C(N=C(C=C2)C3=N[C@@H]([C@@H](ON3)C4CC4)C5=CC=C(C=C5)Cl)OC
InChI
InChI=1S/C22H22ClN5O2/c1-13-11-28(12-24-13)18-10-9-17(25-22(18)29-2)21-26-19(14-5-7-16(23)8-6-14)20(30-27-21)15-3-4-15/h5-12,15,19-20H,3-4H2,1-2H3,(H,26,27)/t19-,20+/m1/s1
InChIKey
IOQORVDNYPOZPL-UXHICEINSA-N
Chemical Structure
2D Structure
2D structure of (5R,6S)-5-(4-chlorophenyl)-6-cyclopropyl-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
CAS: 2085780-87-4
CID: 126599752
Formula: C22H22ClN5O2
MW: 423.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight423.9
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass423.1462027
Monoisotopic Mass423.1462027
Topological Polar Surface Area73.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity625
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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