N-(4-acetyl-5-methyl-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide

Base Information

Chemical Name:N-(4-acetyl-5-methyl-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
CAS No.:72926-24-0
Molecular Formula:C13H15N3O2S
Molecular Weight:277.347
Hs Code.:2934999090
European Community (EC) Number:663-070-7
UNII:ZA4OIM722G
DSSTox Substance ID:DTXSID40972156
Wikidata:Q27166285
Pharos Ligand ID:6K4K2XNR23Z3
ChEMBL ID:CHEMBL1413473
Mol file:72926-24-0.mol

Synonyms:K 858;K-858;K858 cpd

Suppliers and Price of N-(4-acetyl-5-methyl-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide

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

Usbiological
K 858
10mg
$ 409.00

TRC
K 858
10mg
$ 120.00

Tocris
K 858 ≥99%(HPLC)
50
$ 548.00

Tocris
K 858 ≥99%(HPLC)
10
$ 128.00

Sigma-Aldrich
K 858 ≥98% (HPLC)
5mg
$ 103.00

Sigma-Aldrich
K 858 ≥98% (HPLC)
25mg
$ 408.00

DC Chemicals
K 858 >98%
1 g
$ 1600.00

DC Chemicals
K 858 >98%
100 mg
$ 400.00

CSNpharm
K 858
100mg
$ 597.00

CSNpharm
K 858
25mg
$ 183.00

Total 19 raw suppliers

Chemical Property of N-(4-acetyl-5-methyl-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide

Chemical Property:

Melting Point:216-217 °C(Solv: ethanol (64-17-5))
PKA:8.61±0.40(Predicted)
PSA：90.56000
Density:1.27±0.1 g/cm3(Predicted)
LogP:2.07550
Storage Temp.:Store at +4°C
Solubility.:DMSO: ≥20mg/mL
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:277.08849790
Heavy Atom Count:19
Complexity:418

Purity/Quality:

99%, ^*data from raw suppliers

K 858 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 22

MSDS Files:: Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(=O)NC1=NN(C(S1)(C)C2=CC=CC=C2)C(=O)C
Description K858 (72926-24-0) is a selective mitotic kinesin Eg5 inhibitor (IC50 = 1.3 μM) which acts in an ATP-noncompetitive manner.1,2?It is at least 150-fold more selective for Eg5 than other members of the kinesin superfamily. K-858 blocks centrosome separation, activates the spindle checkpoint and induces mitotic arrest accompanied by the formation of monopolar spindles. Displays no effect on microtubule polymerization. Selectively displays antiproliferative effects via induction of mitotic cell death in cancer cells over nontransformed cells.1
Uses K 858 is a selective ATP-uncompetitive mitotic kinesin Eg5 inhibitor.

Technology Process of N-(4-acetyl-5-methyl-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide

There total 2 articles about N-(4-acetyl-5-methyl-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide 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: 86.0%