[(1S,2R)-1-Benzyl-2-hydroxy-3-[isobutyl-[(4-aminophenyl)sulfonyl]amino]propyl]carbamic Acid tert-Butyl Ester

CAS: 183004-94-6

Ref. TR-B279950

Product Information

• Name: [(1S,2R)-1-Benzyl-2-hydroxy-3-[isobutyl-[(4-aminophenyl)sulfonyl]amino]propyl]carbamic Acid tert-Butyl Ester
• Synonyms: Carbamic acid, N-[(1S,2R)-3-[[(4-aminophenyl)sulfonyl](2-methylpropyl)amino]-2-hydroxy-1-(phenylmethyl)propyl]-, 1,1-dimethylethyl ester, Carbamic acid, [(1S,2R)-3-[[(4-aminophenyl)sulfonyl](2-methylpropyl)amino]-2-hydroxy-1-(phenylmethyl)propyl]-, 1,1-dimethylethyl ester (9CI), Carbamic acid, [3-[[(4-aminophenyl)sulfonyl](2-methylpropyl)amino]-2-hydroxy-1-(phenylmethyl)propyl]-, 1,1-dimethylethyl ester, [R-(R*,S*)]-, tert-Butyl [(1S,2R)-3-[[(4-aminophenyl)sulfonyl](isobutyl)amino]-1-benzyl-2-hydroxypropyl]carbamate
• Brand: TRC
• Description: Applications Darunavir intermediate, a potent inhibitor of HIV-1 protease.References Debouck, C., et al.: Drug Dev. Res., 21, 1 (1990), Krohn, A., et al.: J. Med. Chem., 34, 3340 (1991), Sham, H., et al.: Antimicrob. Agents Chemother., 42, 3218 (1998),

Chemical properties

• Molecular weight: 491.64
• Formula: C₂₅H₃₇N₃O₅S
• Color/Form: Neat
• InChI: InChI=1S/C25H37N3O5S/c1-18(2)16-28(34(31,32)21-13-11-20(26)12-14-21)17-23(29)22(15-19-9-7-6-8-10-19)27-24(30)33-25(3,4)5/h6-14,18,22-23,29H,15-17,26H2,1-5H3,(H,27,30)/t22-,23+/m0/s1
• InChI key: InChIKey=GSFKNEPGHWUCQO-XZOQPEGZSA-N
• SMILES: CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(N)cc1