Benzyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate

Base Information

Chemical Name:Benzyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate
CAS No.:70637-32-0
Molecular Formula:C28H37N3O5S
Molecular Weight:527.685
Hs Code.:
DSSTox Substance ID:DTXSID50391930
Mol file:70637-32-0.mol

Synonyms:70637-32-0;benzyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate;DTXSID50391930;FT-0734145;N-Formyl-Met-Leu-Phe benzyl ester, >=97% (HPLC);Carbamicacid,[(1S)-1-(hydroxymethyl)-3-butynyl]-,1,1-dimethylethylester

Suppliers and Price of Benzyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate

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
N-Formyl-Met-Leu-Phe benzyl ester ≥97% (HPLC)
10mg
$ 88.50

American Custom Chemicals Corporation
N-FORMYL-MET-LEU-PHE BENZYL ESTER 95.00%
10MG
$ 618.63

Total 4 raw suppliers

Chemical Property of Benzyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate

Chemical Property:

PSA：138.90000
LogP:4.66450
Storage Temp.:−20°C
XLogP3:3.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:16
Exact Mass:527.24539246
Heavy Atom Count:37
Complexity:708

Purity/Quality:

95% ^*data from raw suppliers

N-Formyl-Met-Leu-Phe benzyl ester ≥97% (HPLC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)NC(=O)C(CCSC)NC=O

Technology Process of Benzyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate

There total 8 articles about Benzyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate 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: 59.0%

: 64-18-6
formic acid

: 70637-30-8
H-Met-Leu-Phe-O-CH₂C₆H₅

: 70637-32-0
formyl-Met-Leu-Phe-OCH₂C₆H₅

Guidance literature:: With benzotriazol-1-ol; dicyclohexyl-carbodiimide; In dichloromethane; at 20 ℃; for 36.5h; Cooling;

Reference yield:

: 3392-09-4
Boc-Leu-ONSu

: 70637-32-0
formyl-Met-Leu-Phe-OCH₂C₆H₅

Guidance literature:: Multi-step reaction with 5 steps

1: 75 percent / diisopropylethylamine / dimethylformamide / 12 h / Ambient temperature

2: trifluoroacetic acid / 0.67 h

3: diisopropylethylamine, 1-hydroxybenzotriazole / dimethylformamide / 12 h / Ambient temperature

4: trifluoroacetic acid / 0.67 h

5: diisopropylethylamine / dimethylformamide / 12 h / Ambient temperature

With benzotriazol-1-ol; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; In N,N-dimethyl-formamide;
DOI:10.1055/s-1982-30034

Reference yield:

: 140834-91-9,70637-26-2
(S)-benzyl 2-((S)-2-(tert-butoxycarbonylamino)-4-methylpentanamido)-3-phenylpropanoate

: 70637-32-0
formyl-Met-Leu-Phe-OCH₂C₆H₅

Guidance literature:: Multi-step reaction with 4 steps

1: trifluoroacetic acid / 0.67 h

2: diisopropylethylamine, 1-hydroxybenzotriazole / dimethylformamide / 12 h / Ambient temperature

3: trifluoroacetic acid / 0.67 h

4: diisopropylethylamine / dimethylformamide / 12 h / Ambient temperature

With benzotriazol-1-ol; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; In N,N-dimethyl-formamide;
DOI:10.1055/s-1982-30034