(2S)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanamide
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(2S)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanamide
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CAS No:
956984-72-8
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Formula:
C23H26ClF3N4OS
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Chemical Name:
(2S)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanamide
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Synonyms:
ZINC12542013;AKOS034827530;MCULE-1612868604;Z57025011;(2S)-N-[(1S)-1-(1H-1,3-benzodiazol-2-yl)-3-(methylsulfanyl)propyl]-2-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-3-methylbutanamide;956984-72-8
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CAS No:
(2S)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanamide Basic Attributes
499.0 g/mol
498.1467948 g/mol
Computed Properties
Molecular Weight:499.0
XLogP3:6.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:498.1467948
Monoisotopic Mass:498.1467948
Topological Polar Surface Area:95.1
Heavy Atom Count:33
Complexity:641
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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