AC1LXD80 structure

AC1LXD80

(6-chloro-4-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate

Also Known As: (S)-6-chloro-4-methyl-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-(methylthio)butanoate|(6-chloro-4-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate

CAS: 956325-70-5
Molecular Formula C20H24ClNO6S
Molecular Weight 441.1013 g/mol
LogP 4.30662
Topological Polar Surface Area 94.84 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 441.1013
Monoisotopic Mass 441.1013
Heavy Atoms 29
Complexity 965.82336

Chemical Identifiers

CAS Number 956325-70-5
SMILES CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)[C@H](CCSC)NC(=O)OC(C)(C)C

Product Overview

AC1LXD80 (CAS 956325-70-5), with molecular formula C20H24ClNO6S and molecular weight 441.1013 g/mol. IUPAC: (6-chloro-4-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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