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Home > Encyclopedia > (2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethylbutanoyl]amino]-4-oxobutanoic acid

(2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethylbutanoyl]amino]-4-oxobutanoic acid

(2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethylbutanoyl]amino]-4-oxobutanoic acid structure

(2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethylbutanoyl]amino]-4-oxobutanoic acid 

structure
  • CAS No:

    94236-41-6

  • Formula:

    C26H37N5O7

  • Chemical Name:

    (2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethylbutanoyl]amino]-4-oxobutanoic acid

  • Synonyms:

    Boc-Trp-Leu-Asp;Boc-Trp-Leu-Asp-NH2;Boc-WLD-NH2;tert-butyloxycarbonyl-tryptophyl-leucyl-asparagine;tert-butyloxycarbonyl-tryptophyl-leucyl-asparagine, (D-alpha-asparagine)-isomer;tert-butyloxycarbonyl-tryptophyl-leucyl-asparagine, (L-alpha-asparagine)-isomer;Boc-wld-NH2;Boc-trp-leu-asp;Boc-trp-leu-asp-NH2;DTXSID00912477;tert-Butyloxycarbonyl-tryptophyl-leucyl-asparagine;A846082;(2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-3,3-dimethyl-1-oxobutyl]amino]-4-oxobutanoic acid;(2R)-4-azanyl-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethyl-butanoyl]amino]-4-oxidanylidene-butanoic acid;94236-41-6;N-(2-{[2-{[tert-Butoxy(hydroxy)methylidene]amino}-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino}-1-hydroxy-3,3-dimethylbutylidene)-4-iminohomoserine

(2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethylbutanoyl]amino]-4-oxobutanoic acid Basic Attributes

531.6 g/mol

531.26929854 g/mol

Characteristics

193 Ų

3.4524

170 °C

Drug Information

Boc-Trp-Leu-Asp

Computed Properties

Molecular Weight:531.6
XLogP3:1.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:13
Exact Mass:531.26929854
Monoisotopic Mass:531.26929854
Topological Polar Surface Area:193
Heavy Atom Count:38
Complexity:895
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

Guide of (2R)-4-amino-2-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3,3-dimethylbutanoyl]amino]-4-oxobutanoic acid

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