Seratrodast

Base Information Edit

Chemical Name:Seratrodast
CAS No.:112665-43-7
Deprecated CAS:103186-19-2
Molecular Formula:C22H26O4
Molecular Weight:354.446
Hs Code.:29309070
European Community (EC) Number:692-169-8
NSC Number:759640
UNII:4U58JM421N
DSSTox Substance ID:DTXSID4021397
Nikkaji Number:J1.633.058B
Wikipedia:Seratrodast
Wikidata:Q7452735
NCI Thesaurus Code:C90671
Pharos Ligand ID:G5XUD93ZJSHC
Metabolomics Workbench ID:149946
ChEMBL ID:CHEMBL70972
Mol file:112665-43-7.mol

Synonyms:7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoic acid;AA 2414;AA-2414;ABT-001;seratrodast

Suppliers and Price of Seratrodast

Supply Marketing:Edit

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

Usbiological
AA 2414
10mg
$ 403.00

Tocris
AA2414 ≥98%(HPLC)
10
$ 124.00

Tocris
AA2414 ≥98%(HPLC)
50
$ 504.00

TCI Chemical
Seratrodast >98.0%(HPLC)(T)
1g
$ 122.00

TCI Chemical
Seratrodast >98.0%(HPLC)(T)
100mg
$ 21.00

Matrix Scientific
Seratrodast 97.0%
1g
$ 594.00

DC Chemicals
Seratrodast >98%
1 g
$ 1200.00

DC Chemicals
Seratrodast >98%
100 mg
$ 300.00

DC Chemicals
Seratrodast >98%
250 mg
$ 600.00

CSNpharm
Seratrodast
10mg
$ 47.00

Total 110 raw suppliers

Chemical Property of Seratrodast Edit

Chemical Property:

Appearance/Colour:pale orange solid
Vapor Pressure:0.002mmHg at 25°C
Melting Point:118-120 °C
Refractive Index:1.584
Boiling Point:522.3 °C at 760 mmHg
PKA:4.76±0.10(Predicted)
Flash Point:283.8 °C
PSA：71.44000
Density:1.14 g/cm³
LogP:4.61000
Storage Temp.:Store at +4°C
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:354.18310931
Heavy Atom Count:26
Complexity:633

Purity/Quality:

99% ^*data from raw suppliers

AA 2414 ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=O)C(=C(C1=O)C)C(CCCCCC(=O)O)C2=CC=CC=C2)C
Description Seratrodast, a novel benzoquinone derivative, is the first thromboxane A2 (TxA2) receptor antagonist to reach the market. It is orally active for the treatment of bronchospastic disorders such as asthma. TxA2, a metabolite of the arachidonate cascade, is involved in several cardiovascular and respiratory diseases through its potent biological effects on platelet aggregation and constriction of vascular and respiratory smooth muscles. Seratrodast potently inhibits platelet aggregation and bronchoconstriction induced by a TxA2 mimic and by a variety of spasmogenic prostanoids including PGF2α, PGD2 and 9α,11β-PGF2. Seratrodast shows excellent efficacy in asthma and has been reported to be potentially useful in hyper-responsive disorder. The R-(+)- seratrodast was reported to be the active isomer.
Uses Thromboxane A2-receptor antagonist. Antiasthmatic. Thromboxane A2-receptor antagonist. Antiasthmatic antibacterial

Technology Process of Seratrodast

There total 17 articles about Seratrodast 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: 99.2%

: 4537-09-1
1,4-dimethoxy-2,3,5-trimethyl-benzene

: C₁₃H₁₉NO₂

: 112665-43-7,103186-19-2
seratrodast

Guidance literature:: 1,4-dimethoxy-2,3,5-trimethyl-benzene; C₁₃H₁₉NO₂; With sodium nitrate; aluminum isopropoxide; at 47 ℃; for 2h;

With dipotassium peroxodisulfate; sodium sulfate; at 55 ℃; for 0.833333h;

With niobium(V) oxide; for 3.6h; Temperature;