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Bliretrigine

CAT: 0607-BA7006-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-BA7006-5Size:5 mg
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CAS Number
1233229-75-8
Form
A solid
Molecular Formula
C20H24N4O2
Molecular Weight
352.43
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Bliretrigine

Bliretrigine is a small molecule drug. The usage of the INN stem '-trigine' in the name indicates that Bliretrigine is a sodium channel blocker, signal transduction modulator. Bliretrigine has a monoisotopic molecular weight of 352.19 Da.

CAS Number1233229-75-8
PubChem CID46701178
IUPAC Name(2S)-2-[[1-ethyl-6-(4-methylphenoxy)benzimidazol-2-yl]methylamino]propanamide
Molecular FormulaC20H24N4O2
Molecular Weight352.4
XLogP2.4
Topological Polar Surface Area82.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity467
SMILES
CCN1C2=C(C=CC(=C2)OC3=CC=C(C=C3)C)N=C1CN[C@@H](C)C(=O)N
InChI
InChI=1S/C20H24N4O2/c1-4-24-18-11-16(26-15-7-5-13(2)6-8-15)9-10-17(18)23-19(24)12-22-14(3)20(21)25/h5-11,14,22H,4,12H2,1-3H3,(H2,21,25)/t14-/m0/s1
InChIKey
ZYUAASICHDTDEK-AWEZNQCLSA-N
Chemical Structure
2D Structure
2D structure of Bliretrigine
CAS: 1233229-75-8
CID: 46701178
Formula: C20H24N4O2
MW: 352.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.4
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass352.18992602
Monoisotopic Mass352.18992602
Topological Polar Surface Area82.2 Ų
Heavy Atom Count26
Formal Charge0
Complexity467
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

Alternative Products

CatalogName
HY-145558-01Bliretrigine

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