benzyl N-[(2S,3S)-4-[benzyl-[[(2S)-2-[[(6-ethylpyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoyl]amino]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate
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![benzyl N-[(2S,3S)-4-[benzyl-[[(2S)-2-[[(6-ethylpyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoyl]amino]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4cc2b35f02e5466bbd391f7fb9e5ed93.png "benzyl N-[(2S,3S)-4-[benzyl-[[(2S)-2-[[(6-ethylpyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoyl]amino]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate")
benzyl N-[(2S,3S)-4-[benzyl-[[(2S)-2-[[(6-ethylpyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoyl]amino]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate
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CAS No:
162739-27-7
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Formula:
C40H50N6O5
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Chemical Name:
benzyl N-[(2S,3S)-4-[benzyl-[[(2S)-2-[[(6-ethylpyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoyl]amino]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate
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Synonyms:
162739-27-7;5S-(Benzyloxycarbonyl)amino-2-N-((N-methyl-N-((6-ethyl-2-pyridinyl)methyl)amino)carbonyl)-L-valinylamino-4S-hydroxy-1,6-diphenyl-2-azahexane;Aza. deriv.;DTXSID80936737;benzyl N-[(2S,3S)-4-[benzyl-[[(2S)-2-[[(6-ethylpyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoyl]amino]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate;benzyl N-[(1S,2S)-1-benzyl-3-[benzyl-[[(2S)-2-[[(6-ethyl-2-pyridyl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoyl]amino]amino]-2-hydroxy-propyl]carbamate;N-Benzyl-N-(3-{[(benzyloxy)(hydroxy)methylidene]amino}-2-hydroxy-4-phenylbutyl)-2-{[{[(6-ethylpyridin-2-yl)methyl](methyl)amino}(hydroxy)methylidene]amino}-3-methylbutanehydrazonic acid
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CAS No:
benzyl N-[(2S,3S)-4-[benzyl-[[(2S)-2-[[(6-ethylpyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoyl]amino]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Basic Attributes
694.9 g/mol
694.38426872 g/mol
Computed Properties
Molecular Weight:694.9
XLogP3:5.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:18
Exact Mass:694.38426872
Monoisotopic Mass:694.38426872
Topological Polar Surface Area:136
Heavy Atom Count:51
Complexity:1030
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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