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LTX-401

CAT: 0013-GTR19259632Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19259632Size:5 mg
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Description
LTX-401 is a novel oncolytic amino acid derivative that specifically targets the Golgi apparatus, demonstrating significant potential in cancer therapy. In vitro studies reveal that LTX-401 effectively reduces the viability of various tumor cell lines, exhibiting cytotoxic activity across a range of concentrations. Notably, it shows the highest potency against the human malignant melanoma cell line MDA-MB-435S (IC50 = 13.5 μM) and the lowest activity against the human hepatocellular carcinoma cell line HEPG2 (IC50 = 35.4 μM) . For other cell lines, the IC50 values fall within a narrow range of 19-32 μM. Importantly, LTX-401 does not induce hemolysis in red blood cells at concentrations effective for cancer cell death, with hemolytic activity only observed at much higher concentrations (400 μg/mL = 1087 μM) . Additionally, LTX-401 demonstrates cytotoxicity against non-malignant cell lines, including HUV-EC-C endothelial cells, HaCat keratinocytes, and MRC-5 fibroblasts, suggesting a broad but selective mechanism of action.
CAS Number
1398051-86-9
Purity
>98%
Smiles
Cl.Cl.O=C (C (CN) (CCCC1C=CC=CC=1) CCCC1C=CC=CC=1) NCCN
Molecular Formula
C23H35CL2N3O
Molecular Weight
440.449504137039
Notes
For research use only.

Chemical Information

LTX-401 HCl
CAS Number1398051-86-9
PubChem CID134817186
IUPAC NameN-(2-aminoethyl)-2-(aminomethyl)-5-phenyl-2-(3-phenylpropyl)pentanamide;dihydrochloride
Molecular FormulaC23H35Cl2N3O
Molecular Weight440.4
Topological Polar Surface Area81.1
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count3
Rotatable Bond Count12
Heavy Atom Count29
Formal Charge0
Complexity376
SMILES
C1=CC=C(C=C1)CCCC(CCCC2=CC=CC=C2)(CN)C(=O)NCCN.Cl.Cl
InChI
InChI=1S/C23H33N3O.2ClH/c24-17-18-26-22(27)23(19-25,15-7-13-20-9-3-1-4-10-20)16-8-14-21-11-5-2-6-12-21;;/h1-6,9-12H,7-8,13-19,24-25H2,(H,26,27);2*1H
InChIKey
GYDPAWIYVHOSOJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of LTX-401 HCl
CAS: 1398051-86-9
CID: 134817186
Formula: C23H35Cl2N3O
MW: 440.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight440.4
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count3
Rotatable Bond Count12
Exact Mass439.2157181
Monoisotopic Mass439.2157181
Topological Polar Surface Area81.1 Ų
Heavy Atom Count29
Formal Charge0
Complexity376
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes