AC1N9D0S structure

AC1N9D0S

3-[[1-(3-oxo-1H-2-benzofuran-1-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]methylidene]-2-benzofuran-1-one

Also Known As: KS-000033BE|3-(2-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-2-benzofuran-1(3H)-one|3-[[1-(3-oxo-1H-2-benzofuran-1-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]methylidene]-2-benzofuran-1-one|3-{2-[(3-oxo-2-benzofuran-1-ylidene)methyl]-1H,3H,4H,9H-pyrido[3,4-b]indol-1-yl}-3H-2-benzofuran-1-one

CAS: 861206-52-2
Molecular Formula C28H20N2O4
Molecular Weight 448.1423 g/mol
LogP 5.1478
Topological Polar Surface Area 71.63 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 2
Exact Mass 448.1423
Monoisotopic Mass 448.1423
Heavy Atoms 34
Complexity 1532.4583

Chemical Identifiers

CAS Number 861206-52-2
SMILES C1CN(C(C2=C1C3=CC=CC=C3N2)C4C5=CC=CC=C5C(=O)O4)C=C6C7=CC=CC=C7C(=O)O6

Product Overview

AC1N9D0S (CAS 861206-52-2), with molecular formula C28H20N2O4 and molecular weight 448.1423 g/mol. IUPAC: 3-[[1-(3-oxo-1H-2-benzofuran-1-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]methylidene]-2-benzofuran-1-one.

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