(2S)-6-amino-2-[(2,2,2-trifluoroacetyl)amino]-N-[(2S)-2-[4-(trifluoromethyl)anilino]propanoyl]hexanamide
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![(2S)-6-amino-2-[(2,2,2-trifluoroacetyl)amino]-N-[(2S)-2-[4-(trifluoromethyl)anilino]propanoyl]hexanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/086431a1d2a94eee83b9ab391ada9f34.png "(2S)-6-amino-2-[(2,2,2-trifluoroacetyl)amino]-N-[(2S)-2-[4-(trifluoromethyl)anilino]propanoyl]hexanamide")
(2S)-6-amino-2-[(2,2,2-trifluoroacetyl)amino]-N-[(2S)-2-[4-(trifluoromethyl)anilino]propanoyl]hexanamide
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CAS No:
68739-25-3
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Formula:
C18H22F6N4O3
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Chemical Name:
(2S)-6-amino-2-[(2,2,2-trifluoroacetyl)amino]-N-[(2S)-2-[4-(trifluoromethyl)anilino]propanoyl]hexanamide
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Synonyms:
TFA-Lys-Ala-TFMPA;TFAI;trifluoroacetyl-lysyl-alanyl-trifluoromethylphenylanilide;trifluoroacetyllysylalanine-trifluoromethylphenylanilide;68739-25-3;Tfa-lys-ala-tfmpa;Trifluoroacetyllysylalanine-trifluoromethylphenylanilide;DTXSID20988432;Trifluoroacetyl-lysyl-alanyl-trifluoromethylphenylanilide;L-Alaninamide, N2-(trifluoroacetyl)-L-lysyl-N-(4-(trifluoromethyl)phenyl)-;N-[N~2~-(2,2,2-Trifluoro-1-hydroxyethylidene)lysyl]-2-[4-(trifluoromethyl)anilino]propanimidic acid
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CAS No:
(2S)-6-amino-2-[(2,2,2-trifluoroacetyl)amino]-N-[(2S)-2-[4-(trifluoromethyl)anilino]propanoyl]hexanamide Basic Attributes
456.4 g/mol
456.15960955 g/mol
Computed Properties
Molecular Weight:456.4
XLogP3:2.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:9
Exact Mass:456.15960955
Monoisotopic Mass:456.15960955
Topological Polar Surface Area:113
Heavy Atom Count:31
Complexity:618
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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