(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (2S)-2-(benzenesulfonamido)-3-methylbutanoate
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(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (2S)-2-(benzenesulfonamido)-3-methylbutanoate
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CAS No:
1164125-11-4
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Formula:
C20H22N2O8S
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Chemical Name:
(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (2S)-2-(benzenesulfonamido)-3-methylbutanoate
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Synonyms:
MLS002635385;CHEMBL1896202;HMS3092P15;ZINC3367401;AKOS034827577;MCULE-4114842988;SMR001544533;Z57027542;(6-nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl (2S)-2-benzenesulfonamido-3-methylbutanoate;1164125-11-4
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CAS No:
(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (2S)-2-(benzenesulfonamido)-3-methylbutanoate Basic Attributes
450.5 g/mol
450.10968684 g/mol
Computed Properties
Molecular Weight:450.5
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:450.10968684
Monoisotopic Mass:450.10968684
Topological Polar Surface Area:145
Heavy Atom Count:31
Complexity:726
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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