benzyl N-[(2S)-4-(benzylamino)-1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1,4-dioxobutan-2-yl]carbamate
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![benzyl N-[(2S)-4-(benzylamino)-1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1,4-dioxobutan-2-yl]carbamate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/34ca51b11c3e41979ad7f07de7eb7559.png "benzyl N-[(2S)-4-(benzylamino)-1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1,4-dioxobutan-2-yl]carbamate")
benzyl N-[(2S)-4-(benzylamino)-1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1,4-dioxobutan-2-yl]carbamate
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CAS No:
744198-16-1
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Formula:
C23H25BrN4O5
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Chemical Name:
benzyl N-[(2S)-4-(benzylamino)-1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1,4-dioxobutan-2-yl]carbamate
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Synonyms:
Dihydroisoxazole, 1g;744198-16-1;SCHEMBL1091635;BDBM59179;DTXSID10349371;benzyl N-[(2S)-4-(benzylamino)-1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1,4-dioxobutan-2-yl]carbamate;carbamic acid, [(1S)-1-[[[(3-bromo-4,5-dihydro-5-isoxazolyl)methyl]amino]carbonyl]-3-oxo-3-[(phenylmethyl)amino]propyl]-, phenylmethyl ester;Carbamic acid, [(1S)-1-[[[(3-bromo-4,5-dihydro-5-isoxazolyl)methyl]amino]carbonyl]-3-oxo-3-[(phenylmethyl)amino]propyl]-, phenylmethyl ester (9CI)
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CAS No:
benzyl N-[(2S)-4-(benzylamino)-1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1,4-dioxobutan-2-yl]carbamate Basic Attributes
517.4 g/mol
516.10083 g/mol
DTXSID10349371
Computed Properties
Molecular Weight:517.4
XLogP3:2.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:516.10083
Monoisotopic Mass:516.10083
Topological Polar Surface Area:118
Heavy Atom Count:33
Complexity:692
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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