Phenylmethyl N-[(1S)-2-amino-1-[[4-(1,1-dimethylethoxy)phenyl]methyl]-2-oxoethyl]carbamate

Base Information

Chemical Name:Phenylmethyl N-[(1S)-2-amino-1-[[4-(1,1-dimethylethoxy)phenyl]methyl]-2-oxoethyl]carbamate
CAS No.:39894-76-3
Molecular Formula:C₂₁H₂₆N₂O₄
Molecular Weight:370.448
Hs Code.:
DSSTox Substance ID:DTXSID101122252

Synonyms:DTXSID101122252;39894-76-3;Phenylmethyl N-[(1S)-2-amino-1-[[4-(1,1-dimethylethoxy)phenyl]methyl]-2-oxoethyl]carbamate

Suppliers and Price of Phenylmethyl N-[(1S)-2-amino-1-[[4-(1,1-dimethylethoxy)phenyl]methyl]-2-oxoethyl]carbamate

Supply Marketing:

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

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Chemical Property of Phenylmethyl N-[(1S)-2-amino-1-[[4-(1,1-dimethylethoxy)phenyl]methyl]-2-oxoethyl]carbamate

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:370.18925731
Heavy Atom Count:27
Complexity:475

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)OC1=CC=C(C=C1)CC(C(=O)N)NC(=O)OCC2=CC=CC=C2
Isomeric SMILES:CC(C)(C)OC1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)OCC2=CC=CC=C2

Technology Process of Phenylmethyl N-[(1S)-2-amino-1-[[4-(1,1-dimethylethoxy)phenyl]methyl]-2-oxoethyl]carbamate

There total 1 articles about Phenylmethyl N-[(1S)-2-amino-1-[[4-(1,1-dimethylethoxy)phenyl]methyl]-2-oxoethyl]carbamate 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:

: 16879-90-6,198828-72-7
N-α-benzyloxycarbamoyl-O-t-butyl-L-tyrosine dicyclohexylammonium salt

: 39894-76-3
(S)-benzyl-1-amino-3-(4-t-butoxyphenyl)-1-oxopropan-2-ylcarbamate

Guidance literature:: With ammonium hydroxide; In tetrahydrofuran; for 0.5h; Cooling with ice; Inert atmosphere;
DOI:10.1021/jm8004515

Reference yield:

: 39894-76-3
(S)-benzyl-1-amino-3-(4-t-butoxyphenyl)-1-oxopropan-2-ylcarbamate

: (S)-2-amino-3-[4-(tert-butoxy)phenyl]propanamide

Guidance literature:: With palladium 10% on activated carbon; hydrogen; In ethanol; N,N-dimethyl-formamide; for 2.5h; Inert atmosphere;
DOI:10.1021/jm8004515

Reference yield:

: 39894-76-3
(S)-benzyl-1-amino-3-(4-t-butoxyphenyl)-1-oxopropan-2-ylcarbamate

: 1082954-31-1
(S)-2-amino-N-((S)-1-amino-3-(4-t-butoxyphenyl)-1-oxopropan-2-yl)propanamide

Guidance literature:: Multi-step reaction with 3 steps

1.1: hydrogen / palladium 10% on activated carbon / ethanol / 3 h / Inert atmosphere

2.1: 1,1'-carbonyldiimidazole / tetrahydrofuran / 2 h / Inert atmosphere

2.2: 48 h / Inert atmosphere

3.1: hydrogen / palladium 10% on activated carbon / ethanol / 20 h / Inert atmosphere

With hydrogen; 1,1'-carbonyldiimidazole; palladium 10% on activated carbon; In tetrahydrofuran; ethanol;