benzyl N-[(2S)-1-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]amino]-4-amino-1,4-dioxobutan-2-yl]carbamate

Names

[ CAS No. ]:
136522-18-4

[ Name ]:
benzyl N-[(2S)-1-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]amino]-4-amino-1,4-dioxobutan-2-yl]carbamate

[Synonym ]:
Benzenepropanamide,N-(4,5-dihydronaphtho[1,2-d]thiazol-2-yl)
2-<3(S)-<<N-(Benzyloxycarbonyl)-L-asparaginyl>amino>-2(R)-hydroxy-4-phenylbutyl>-N-tert-butyldecahydro-(4aS,8aS)-isoquinoline-3(S)-carboxamide
2-<3-(phenyl)propanoyl>aminobenzo<e>-4,5-dihydrobenzothiazole

Chemical & Physical Properties

[ Density]:
1.186g/cm3

[ Boiling Point ]:
935.5ºC at 760 mmHg

[ Molecular Formula ]:
C36H51N5O6

[ Molecular Weight ]:
649.82000

[ Flash Point ]:
519.6ºC

[ Exact Mass ]:
649.38400

[ PSA ]:
174.55000

[ LogP ]:
6.01320

[ Vapour Pressure ]:
0mmHg at 25°C

[ Index of Refraction ]:
1.567

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • N-(TERT-BUTYL)DECAHYDRO-3-ISOQUINOLINECARBOXAMIDE
  • Z-Asn-OH
  • (3S,4aS,8aS)-2-[(3S)-3-amino-2-hydroxy-4-phenylbutyl]-N-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxamide
  • L-Phenylalanine
  • H-Tic-OH
  • N-Cbz-L-Phenylalanine
  • N-tert-butyl-2-[2(R)-hydroxy-4-phenyl-3(S)-azidobutyl]decahydro(4aS,8aS)-isoquinoline-3(S)-carboxamide
  • 4(S)-(1(S)-Azido-2-phenylethyl)-1,3,2-dioxathiolane 2,2-dioxide

DownStream

  • Saquinavir

Related Compounds

  • 1-(4-Fluoro-2-hydroxy-5-nitrophenyl)ethanone
  • 1-(prop-2-en-1-yl)-1H-indazol-6-amine
  • 1-(2-Fluoroethyl)-1H-indazol-6-amine
  • 2-[[6-Bromo-1-[(4-oxo-2-thioxo-5-thiazolidinylidene)methyl]-2-naphthalenyl]oxy]-acetic Acid
  • D-Glucopyranose, 1,3,4-triacetate 2,6-bis(4-methylbenzenesulfonate)
  • 3,5-Dimethoxy-I+/--octylbenzenemethanol
  • Carbamic acid, [(3-chloro-4,5-dihydro-5-isoxazolyl)methyl]-, phenylmethyl ester
  • (4-Nitrophenyl)methyl 3-[2-(phenylmethoxy)ethoxy]propanoate
  • Methyl I+/--hydroxy-2-methoxy-4-pyridineacetate
  • Ethyl 4-methyl-3-(2,4,6-trimethylphenyl)-1H-pyrrole-2-carboxylate
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