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tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Base Information
  • Chemical Name:tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
  • CAS No.:121995-36-6
  • Molecular Formula:C32H45 N7 O5
  • Molecular Weight:607.7436
  • Hs Code.:
  • DSSTox Substance ID:DTXSID50153454
  • Wikidata:Q83020330
  • Mol file:121995-36-6.mol
tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Synonyms:((1,1-dimethylethoxy)carbonyl)-L-phenylalanyl-N(1-(cyclohexylmethyl)-2-hydroxy-2-(1H-imidazol-2-yl)ethyl)-L-histidinamide;Boc-Phe-N-(-1-(cyclohexylmethyl)-2-hydroxy-2-(1H-imidazol-2-yl)ethyl)histidinamide;SQ 30774;SQ-30774

Suppliers and Price of tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
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Chemical Property of tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
Chemical Property:
  • Vapor Pressure:0mmHg at 25°C 
  • Boiling Point:913.3°Cat760mmHg 
  • Flash Point:506.1°C 
  • Density:1.237g/cm3 
  • XLogP3:4
  • Hydrogen Bond Donor Count:6
  • Hydrogen Bond Acceptor Count:8
  • Rotatable Bond Count:15
  • Exact Mass:607.34821756
  • Heavy Atom Count:44
  • Complexity:919
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MSDS Files:
Useful:
  • Canonical SMILES:CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC(=O)C(CC2=CN=CN2)NC(CC3CCCCC3)C(C4=NC=CN4)O
  • Isomeric SMILES:CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(=O)[C@H](CC2=CN=CN2)N[C@@H](CC3CCCCC3)[C@H](C4=NC=CN4)O
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