L-Valinamide, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-L-prolyl-N(sup 6)-((1,1-dimethylethoxy)carbonyl)-L-lysyl-L-prolyl-

Base Information

Chemical Name:L-Valinamide, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-L-prolyl-N(sup 6)-((1,1-dimethylethoxy)carbonyl)-L-lysyl-L-prolyl-
CAS No.:106039-80-9
Molecular Formula:C₂₉H₄₉ClN₈O₈
Molecular Weight:673.21
Hs Code.:
DSSTox Substance ID:DTXSID70909879
Wikidata:Q76156412

Synonyms:BRN 4635031;106039-80-9;L-Valinamide, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-L-prolyl-N(sup 6)-((1,1-dimethylethoxy)carbonyl)-L-lysyl-L-prolyl-;C29H49ClN8O8;DTXSID70909879;C29-H49-Cl-N8-O8;1-{N~6~-[tert-Butoxy(hydroxy)methylidene]lysyl}-N-(1-{[{1-[(2-chloroethyl)(nitroso)carbamoyl]pyrrolidin-2-yl}(hydroxy)methylidene]amino}-3-methyl-1-oxobutan-2-yl)pyrrolidine-2-carboximidic acid

Suppliers and Price of L-Valinamide, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-L-prolyl-N(sup 6)-((1,1-dimethylethoxy)carbonyl)-L-lysyl-L-prolyl-

Supply Marketing:

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

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Chemical Property of L-Valinamide, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-L-prolyl-N(sup 6)-((1,1-dimethylethoxy)carbonyl)-L-lysyl-L-prolyl-

Chemical Property:

Density:1.38g/cm³
XLogP3:1.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:15
Exact Mass:672.3361882
Heavy Atom Count:46
Complexity:1120

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)C(C(=O)NC(=O)C1CCCN1C(=O)N(CCCl)N=O)NC(=O)C2CCCN2C(=O)C(CCCCNC(=O)OC(C)(C)C)N
Isomeric SMILES:CC(C)[C@@H](C(=O)NC(=O)[C@@H]1CCCN1C(=O)N(CCCl)N=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCNC(=O)OC(C)(C)C)N

Technology Process of L-Valinamide, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-L-prolyl-N(sup 6)-((1,1-dimethylethoxy)carbonyl)-L-lysyl-L-prolyl-

There total 5 articles about L-Valinamide, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-L-prolyl-N(sup 6)-((1,1-dimethylethoxy)carbonyl)-L-lysyl-L-prolyl- 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: 55.0%

: 106039-79-6
H-Pro-Lys(Boc)-Pro-Val-MH₂

: 80354-49-0
N-(2-chloroethyl)-N-nitrosocarbamic acid N-hydroxypyrrolidine-2,5-dione ester

: 106039-80-9
Q(NO)-Pro-Lys(BOC)-Pro-Val-NH2

Guidance literature:: With triethylamine; In N,N-dimethyl-formamide; for 3h;
DOI:10.1021/jm00386a024

Reference yield:

: (S)-2-Ethoxycarbonyloxycarbonyl-pyrrolidine-1-carboxylic acid benzyl ester

: 106039-80-9
Q(NO)-Pro-Lys(BOC)-Pro-Val-NH2

Guidance literature:: Multi-step reaction with 3 steps

1: N-methylmorpholine / CH₂Cl₂ / 2.5 h / 0 - 20 °C

2: H₂ / Pd/C / methanol / 3 h

3: 55 percent / triethylamine / dimethylformamide / 3 h

With 4-methyl-morpholine; hydrogen; triethylamine; palladium on activated charcoal; In methanol; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm00386a024

Reference yield:

: 106039-78-5
Z-Pro-Lys(BOC)-Pro-Val-NH₂

: 106039-80-9
Q(NO)-Pro-Lys(BOC)-Pro-Val-NH2

Guidance literature:: Multi-step reaction with 2 steps

1: H₂ / Pd/C / methanol / 3 h

2: 55 percent / triethylamine / dimethylformamide / 3 h

With hydrogen; triethylamine; palladium on activated charcoal; In methanol; N,N-dimethyl-formamide;
DOI:10.1021/jm00386a024