AC1O1WCH structure

AC1O1WCH

(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(3-imidazol-1-ylpropyl)-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione

Also Known As: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(3-imidazol-1-ylpropyl)-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione|1-(3-(1H-imidazol-1-yl)propyl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-5-(3-(isopentyloxy)phenyl)-1H-pyrrol-2(5H)-one

CAS: 577791-38-9
Molecular Formula C30H33N3O6
Molecular Weight 531.23694 g/mol
LogP 4.5912
Topological Polar Surface Area 103.12 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 10
Exact Mass 531.23694
Monoisotopic Mass 531.23694
Heavy Atoms 39
Complexity 1364.777

Chemical Identifiers

CAS Number 577791-38-9
SMILES CC(C)CCOC1=CC=CC(=C1)C2/C(=C(/C3=CC4=C(C=C3)OCCO4)\O)/C(=O)C(=O)N2CCCN5C=CN=C5

Product Overview

AC1O1WCH (CAS 577791-38-9), with molecular formula C30H33N3O6 and molecular weight 531.23694 g/mol. IUPAC: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(3-imidazol-1-ylpropyl)-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione.

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