Mga8LX553F

Base Information

Chemical Name:Mga8LX553F
CAS No.:252770-39-1
Molecular Formula:C₂₈H₃₅NO₃S
Molecular Weight:465.657
Hs Code.:
UNII:MGA8LX553F
Pharos Ligand ID:PLXF5SN2MKKM
ChEMBL ID:CHEMBL119580

Synonyms:MGA8LX553F;GPI1511;GPI-1511;UNII-MGA8LX553F;CHEMBL119580;S-(3,3-Diphenylpropyl) (2S)-1-(3,3-dimethyl-1,2-dioxopentyl)-2-piperidinecarbothioate;1-((2S)-2-(((3,3-Diphenylpropyl)sulfanyl)carbonyl)piperidin-1-yl)-3,3-dimethylpentane-1,2-dione;2-Piperidinecarbothioic acid, 1-(3,3-dimethyl-1,2-dioxopentyl)-, S-(3,3-diphenylpropyl) ester, (2S)-;252770-39-1;SCHEMBL7757995;BDBM50116637;LS-114472;1-(3,3-Dimethyl-2-oxo-pentanoyl)-piperidine-2-carbothioic acid S-(3,3-diphenyl-propyl) ester

Suppliers and Price of Mga8LX553F

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

Total 0 raw suppliers

Chemical Property of Mga8LX553F

Chemical Property:

XLogP3:6.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:10
Exact Mass:465.23376515
Heavy Atom Count:33
Complexity:646

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCC(C)(C)C(=O)C(=O)N1CCCCC1C(=O)SCCC(C2=CC=CC=C2)C3=CC=CC=C3
Isomeric SMILES:CCC(C)(C)C(=O)C(=O)N1CCCC[C@H]1C(=O)SCCC(C2=CC=CC=C2)C3=CC=CC=C3

Technology Process of Mga8LX553F

There total 11 articles about Mga8LX553F 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:

: 119-61-9
benzophenone

: 252770-39-1
1-(3,3-dimethyl-2-oxo-pentanoyl)-piperidine-2-carbothioic acid S-(3,3-diphenyl-propyl) ester

Guidance literature:: Multi-step reaction with 7 steps

1: tetrahydrofuran / Heating

2: H₂ / 10 percent Pd/C / tetrahydrofuran / 2068.59 Torr

3: LiAlH₄ / tetrahydrofuran / 3 h / Heating

4: 88 percent / CBr₄; Ph₃P / CH₂Cl₂ / 24 h / 0 °C

5: ethanol / 24 h / Heating

6: NaOH / ethanol / 2 h / Heating

7: DCC; DMAP / CH₂Cl₂ / 24 h / 20 °C

With dmap; sodium hydroxide; lithium aluminium tetrahydride; carbon tetrabromide; hydrogen; dicyclohexyl-carbodiimide; triphenylphosphine; palladium on activated charcoal; In tetrahydrofuran; ethanol; dichloromethane;
DOI:10.1021/jm010556c

Reference yield:

: 3461-34-5
methyl 3,3-diphenylacrylate

: 252770-39-1
1-(3,3-dimethyl-2-oxo-pentanoyl)-piperidine-2-carbothioic acid S-(3,3-diphenyl-propyl) ester

Guidance literature:: Multi-step reaction with 6 steps

1: H₂ / 10 percent Pd/C / tetrahydrofuran / 2068.59 Torr

2: LiAlH₄ / tetrahydrofuran / 3 h / Heating

3: 88 percent / CBr₄; Ph₃P / CH₂Cl₂ / 24 h / 0 °C

4: ethanol / 24 h / Heating

5: NaOH / ethanol / 2 h / Heating

6: DCC; DMAP / CH₂Cl₂ / 24 h / 20 °C

With dmap; sodium hydroxide; lithium aluminium tetrahydride; carbon tetrabromide; hydrogen; dicyclohexyl-carbodiimide; triphenylphosphine; palladium on activated charcoal; In tetrahydrofuran; ethanol; dichloromethane;
DOI:10.1021/jm010556c