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EHT-6706

CAT: 0013-GTR19208491-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19208491-01Size:25 mg
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Description
EHT-6706 is a potent colchicine-site tubulin polymerization inhibitor with broad-spectrum antiproliferative activity against drug-resistant tumor cell lines. It also functions as a vascular-disrupting agent, inhibiting angiogenesis in vitro by disrupting endothelial tube formation, migration, and monolayer integrity, as supported by transcriptomic analyses of antiangiogenic pathways.
CAS Number
1351592-10-3
Smiles
C (C=1C2=C (C (N) =C (OCC) C=C2) C=NC1) C3=CC (OC) =C (OC) C (OC) =C3
Molecular Formula
C21H24N2O4
Molecular Weight
368.43
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

7-Ethoxy-4-(3,4,5-trimethoxybenzyl)isoquinolin-8-amine

a tubulin-binding agent with antineoplastic activity

CAS Number1351592-10-3
PubChem CID54760530
IUPAC Name7-ethoxy-4-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-8-amine
Molecular FormulaC21H24N2O4
Molecular Weight368.4
XLogP3.6
Topological Polar Surface Area75.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity438
SMILES
CCOC1=C(C2=C(C=C1)C(=CN=C2)CC3=CC(=C(C(=C3)OC)OC)OC)N
InChI
InChI=1S/C21H24N2O4/c1-5-27-17-7-6-15-14(11-23-12-16(15)20(17)22)8-13-9-18(24-2)21(26-4)19(10-13)25-3/h6-7,9-12H,5,8,22H2,1-4H3
InChIKey
INAKKEXXSTWCKJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Ethoxy-4-(3,4,5-trimethoxybenzyl)isoquinolin-8-amine
CAS: 1351592-10-3
CID: 54760530
Formula: C21H24N2O4
MW: 368.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight368.4
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass368.17360725
Monoisotopic Mass368.17360725
Topological Polar Surface Area75.8 Ų
Heavy Atom Count27
Formal Charge0
Complexity438
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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