N-((1S,2S)-2-Amino-1,2-diphenylethyl)-2,4,6-triisopropylbenzenesulfonamide

Base Information

• Chemical Name: N-((1S,2S)-2-Amino-1,2-diphenylethyl)-2,4,6-triisopropylbenzenesulfonamide
• CAS No.: 247923-41-7
• Molecular Formula: C29H38N2O2S
• Molecular Weight: 478.68900
• European Community (EC) Number: 827-273-6
• Nikkaji Number: J1.992.749K
• Wikidata: Q76415906
• Mol file: 247923-41-7.mol

Synonyms:247923-41-7;N-((1S,2S)-2-Amino-1,2-diphenylethyl)-2,4,6-triisopropylbenzenesulfonamide;N-[(1S,2S)-2-aMino-1,2-diphenylethyl]-2,4,6-tris(1-Methylethyl)-BenzenesulfonaMide;N-[(1S,2S)-2-Amino-1,2-diphenylethyl]-2,4,6-trisisopropylbenzenesulfonamide;N-[(1S,2S)-2-Amino-1,2-diphenylethyl]-2,4,6-tri(propan-2-yl)benzenesulfonamide;SCHEMBL15043438;MFCD22988918;(S,S)-N-(2,4,6-Triisopropylbenzenesulfonyl)-1,2-diphenylethanediamine;BS-51394;CS-0093719;D83647;N-[(1S,2S)-1,2-Diphenyl-2-aminoethyl]-2,4,6-triisopropylbenzenesulfonamide;N-[(1S,2S)-2-Amino-1,2-diphenyl)ethyl]-2,4,6-tris(1-methylethyl)benzenesulfonamide;N-[(1S,2S)-2-Amino-1,2-diphenylethyl]-2,4,6- trisisopropylbenzenesulfonam ide

Chemical Property of N-((1S,2S)-2-Amino-1,2-diphenylethyl)-2,4,6-triisopropylbenzenesulfonamide

Chemical Property:

• Melting Point: 166-167 °C
• Boiling Point: 584.4±60.0 °C(Predicted)
• PKA: 10.87±0.50(Predicted)
• PSA: 80.57000
• Density: 1.104±0.06 g/cm3(Predicted)
• LogP: 8.94840
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 478.26539963
• Heavy Atom Count: 34
• Complexity: 684

Purity/Quality:

99% ^*data from raw suppliers

N-[(1S,2S)-2-Amino-1,2-diphenyl)ethyl]-2,4,6-tris(1-methylethyl)benzenesulfonamide, 98% (S,S)-TipsDPEN ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)NC(C2=CC=CC=C2)C(C3=CC=CC=C3)N)C(C)C
• Isomeric SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N[C@@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)N)C(C)C

Technology Process of N-((1S,2S)-2-Amino-1,2-diphenylethyl)-2,4,6-triisopropylbenzenesulfonamide

There total 1 articles about N-((1S,2S)-2-Amino-1,2-diphenylethyl)-2,4,6-triisopropylbenzenesulfonamide 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: 93.0%

2,4,6-triisopropylphenylsulfonyl chloride (6553-96-4) + (S,S)-1,2-diphenyl-1,2-diaminoethane (29841-69-8) → (-)-(1S,2S)-N-(2,4,6-triisopropybenzenesulfonyl)-1,2-diphenylethylenediamine (247923-41-7,852212-92-1)

Guidance literature:

With triethylamine; In tetrahydrofuran; at 20 ℃; for 12h; Cooling with ice;

DOI:10.1039/c0ob00757a

upstream raw materials:

2,4,6-triisopropylphenylsulfonyl chloride

(S,S)-1,2-diphenyl-1,2-diaminoethane

Refernces

• 1、 Tang, Yu,Xu, Jian,Yang, Jian,Lin, Lili,Feng, Xiaoming,Liu, Xiaohua. "Asymmetric Three-Component Reaction for the Synthesis of Tetrasubstituted Allenoates via Allenoate-Copper Intermediates". supporting information. p. 1658 - 1672. Retrieved 2018/05/16.
• 2、 ?terk, Damjan,Stephan, Massoud S.,Mohar, Barbara. "Transfer hydrogenation of activated ketones using novel chiral Ru(II)-N-arenesulfonyl-1,2-diphenylethylenediamine complexes". . p. 535 - 537. Retrieved 2007/10/03.