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AXC-715 trihydrochloride

CAT: 0013-GTR19243696-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19243696-01Size:500 mg
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Description
AXC-715 (T785) trihydrochloride is a TLR7/TLR8 dual agonist, extracted from patent WO2020168017 A1. AXC-715 trihydrochloride, compound D from WO2020190734A1, can be used for synthesis of antibody-adjuvant immunoconjugates, comprising an antibody construct that binds programmed death-ligand 1 (PD-L1) linked to one or more adjuvants.
CAS Number
2479276-17-8
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 125 mg/mL (297.05 mM; Ultrasonic)
Smiles
NC1=NC2=C (C=CC=C2) C3=C1N=C (CCCC) N3CCCCN.Cl.Cl.Cl
Molecular Formula
C18H28Cl3N5
Molecular Weight
420.81
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

1-(4-Aminobutyl)-2-butyl-1H-imidazo[4,5-c]quinolin-4-amine Trihydrochloride
CAS Number2479276-17-8
PubChem CID155908840
IUPAC Name1-(4-aminobutyl)-2-butylimidazo[4,5-c]quinolin-4-amine;trihydrochloride
Molecular FormulaC18H28Cl3N5
Molecular Weight420.8
Topological Polar Surface Area82.8
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity363
SMILES
CCCCC1=NC2=C(N1CCCCN)C3=CC=CC=C3N=C2N.Cl.Cl.Cl
InChI
InChI=1S/C18H25N5.3ClH/c1-2-3-10-15-22-16-17(23(15)12-7-6-11-19)13-8-4-5-9-14(13)21-18(16)20;;;/h4-5,8-9H,2-3,6-7,10-12,19H2,1H3,(H2,20,21);3*1H
InChIKey
ZSUHKPUPLPQJGC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(4-Aminobutyl)-2-butyl-1H-imidazo[4,5-c]quinolin-4-amine Trihydrochloride
CAS: 2479276-17-8
CID: 155908840
Formula: C18H28Cl3N5
MW: 420.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight420.8
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass419.141029
Monoisotopic Mass419.141029
Topological Polar Surface Area82.8 Ų
Heavy Atom Count26
Formal Charge0
Complexity363
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

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