AC1LX21K structure

AC1LX21K

(2S)-2-[[2-[[2-[3-(4-bromophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]-3-methylbutanoic acid

Also Known As: EiM07-29195|(2S)-2-[[2-[[2-[3-(4-bromophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]-3-methylbutanoic acid|(S)-2-(2-(2-(3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamido)acetamido)-3-methylbutanoic acid

CAS: 956958-50-2
Molecular Formula C27H25BrN2O7
Molecular Weight 568.08453 g/mol
LogP 4.16122
Topological Polar Surface Area 138.85 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 568.08453
Monoisotopic Mass 568.08453
Heavy Atoms 37
Complexity 1567.9678

Chemical Identifiers

CAS Number 956958-50-2
SMILES CC1=C(C(=O)OC2=CC3=C(C=C12)C(=CO3)C4=CC=C(C=C4)Br)CC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)O

Product Overview

AC1LX21K (CAS 956958-50-2), with molecular formula C27H25BrN2O7 and molecular weight 568.08453 g/mol. IUPAC: (2S)-2-[[2-[[2-[3-(4-bromophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]-3-methylbutanoic acid.

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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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