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D-687

CAT: 0013-GTR19238621-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19238621-03Size:100 mg
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Description
D-687 is a small molecule inhibitor targeting Tau and amyloid-β (Aβ) pathologies. It exhibits neuroprotective effects by reversing Aβ1–42-induced cytotoxicity in SH-SY5Y cells in vitro, supporting its research application in Alzheimer's disease models.
CAS Number
2276762-06-0
Field of Research
Neuroscience, Signal Transduction
Smiles
OC=1C=CC (=CC1O) C2=CC=C (C=C2) N3CCN (CC3) CCN (C (C) C) C (C) C
Molecular Formula
C24H35N3O2
Molecular Weight
397.55
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-[4-[4-[2-[Di(propan-2-yl)amino]ethyl]piperazin-1-yl]phenyl]benzene-1,2-diol
CAS Number2276762-06-0
PubChem CID137460085
IUPAC Name4-[4-[4-[2-[di(propan-2-yl)amino]ethyl]piperazin-1-yl]phenyl]benzene-1,2-diol
Molecular FormulaC24H35N3O2
Molecular Weight397.6
XLogP4.4
Topological Polar Surface Area50.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity463
SMILES
CC(C)N(CCN1CCN(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)O)O)C(C)C
InChI
InChI=1S/C24H35N3O2/c1-18(2)27(19(3)4)16-13-25-11-14-26(15-12-25)22-8-5-20(6-9-22)21-7-10-23(28)24(29)17-21/h5-10,17-19,28-29H,11-16H2,1-4H3
InChIKey
YKJRVXQDFUFGPV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-[4-[4-[2-[Di(propan-2-yl)amino]ethyl]piperazin-1-yl]phenyl]benzene-1,2-diol
CAS: 2276762-06-0
CID: 137460085
Formula: C24H35N3O2
MW: 397.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight397.6
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass397.27292737
Monoisotopic Mass397.27292737
Topological Polar Surface Area50.2 Ų
Heavy Atom Count29
Formal Charge0
Complexity463
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
T200738-01D-687
022895WYE-687
sc-100663CABC1 (687)

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