Elesclomol

Base Information

Chemical Name:Elesclomol
CAS No.:488832-69-5
Molecular Formula:C19H20N4O2S2
Molecular Weight:400.525
Hs Code.:
NSC Number:174939
UNII:6UK191M53P
DSSTox Substance ID:DTXSID2042642
Nikkaji Number:J3.403.368D
Wikipedia:Elesclomol
Wikidata:Q5359460
NCI Thesaurus Code:C75291
Metabolomics Workbench ID:149553
ChEMBL ID:CHEMBL1972860
Mol file:488832-69-5.mol

Synonyms:elesclomol;STA 4783;STA-4783;STA4783

Suppliers and Price of Elesclomol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
Elesclomol ≥98% (HPLC)
5MG
$ 81.90

Sigma-Aldrich
Elesclomol ≥98% (HPLC)
25MG
$ 331.00

Medical Isotopes, Inc.
Elesclomol 99.06%
5 mg
$ 990.00

DC Chemicals
Elesclomol(STA-4783) >98%
1 g
$ 1500.00

DC Chemicals
Elesclomol(STA-4783) >98%
250 mg
$ 750.00

Crysdot
Elesclomol 98+%
50mg
$ 500.00

Crysdot
Elesclomol 98+%
5mg
$ 88.00

Crysdot
Elesclomol 98+%
10mg
$ 165.00

Crysdot
Elesclomol 98+%
100mg
$ 708.00

ChemScene
Elesclomol 99.80%
50mg
$ 720.00

Total 35 raw suppliers

Chemical Property of Elesclomol

Chemical Property:

Refractive Index:1.667
PKA:7.99±0.70(Predicted)
PSA：128.86000
Density:1.313 g/cm³
LogP:2.83570
Solubility.:insoluble in H2O; ≥20.15 mg/mL in DMSO; ≥5.68 mg/mL in EtOH with gentle warming and ultrasonic
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:400.10276824
Heavy Atom Count:27
Complexity:510

Purity/Quality:

99%, ^*data from raw suppliers

Elesclomol ≥98% (HPLC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C(=S)C1=CC=CC=C1)NC(=O)CC(=O)NN(C)C(=S)C2=CC=CC=C2
Recent ClinicalTrials:STA-4783/Paclitaxel or Paclitaxel Alone in Melanoma
Recent EU Clinical Trials:A Randomized, Double-Blind, Phase III Trial of STA-4783 in Combination with Paclitaxel versus Paclitaxel Alone for Treatment of Chemotherapy-Na?ve Subjects with Stage IV Metastatic Melanoma

Technology Process of Elesclomol

There total 12 articles about Elesclomol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 82.0%

: 141-82-2
malonic acid

: 21048-05-5
N-methylbenzothiohydrazide

: 488832-69-5
elesclomol

Guidance literature:: With N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In N,N-dimethyl-formamide; at 17 - 25 ℃; for 2h; Product distribution / selectivity; Cooling with water-ice;

Reference yield: 70.0%

: 21048-05-5
N-methylbenzothiohydrazide

: 1663-67-8
malonoyl dichloride

: 488832-69-5
elesclomol

Guidance literature:: With triethylamine; In ethyl acetate;
DOI:10.1016/j.jinorgbio.2013.10.005

Reference yield:

: C₁₉H₂₀N₄O₄

: 488832-69-5
elesclomol

Guidance literature:: C₁₉H₂₀N₄O₄; With perchloric acid; In water; at 0 - 20 ℃;

With sodium sulfide; In water; acetone; at 20 ℃; for 0.5h;

With hydrogenchloride; In water;
DOI:10.1016/j.bmcl.2013.07.032