Products for Research Use Only
RegisterLogin

WN1316

CAT: 0931-T35135-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T35135-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1356959-71-1
Target
Others, Nrf2
Related Pathways
Others, Immunology/Inflammation
Bioactivity
WN1316 is a unique neuroprotectant against oxidative injury, being a highly promising remedy for the treatment of amyotrophic lateral sclerosis (ALS) .
Smiles
O=C(CN(C)C1=C(C)C=C(C)C=C1C)NC2=NC=C(C3=CC=CC=N3)N2.Cl.Cl.Cl
Molecular Formula
C20H26Cl3N5O
Molecular Weight
458.81
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

WN-1316 trihydrochloride
CAS Number1356959-71-1
PubChem CID87057556
IUPAC NameN-(5-pyridin-2-yl-1H-imidazol-2-yl)-2-(N,2,4,6-tetramethylanilino)acetamide;trihydrochloride
Molecular FormulaC20H26Cl3N5O
Molecular Weight458.8
Topological Polar Surface Area73.9
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity461
SMILES
CC1=CC(=C(C(=C1)C)N(C)CC(=O)NC2=NC=C(N2)C3=CC=CC=N3)C.Cl.Cl.Cl
InChI
InChI=1S/C20H23N5O.3ClH/c1-13-9-14(2)19(15(3)10-13)25(4)12-18(26)24-20-22-11-17(23-20)16-7-5-6-8-21-16;;;/h5-11H,12H2,1-4H3,(H2,22,23,24,26);3*1H
InChIKey
XZNHUZDSSZMVLD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of WN-1316 trihydrochloride
CAS: 1356959-71-1
CID: 87057556
Formula: C20H26Cl3N5O
MW: 458.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight458.8
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass457.120294
Monoisotopic Mass457.120294
Topological Polar Surface Area73.9 Ų
Heavy Atom Count29
Formal Charge0
Complexity461
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-120570WN1316

Popular Products