(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-one
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![(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6b8a002d3c9f4bdabf5fd38edc9b351e.png "(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-one")
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-one
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CAS No:
900277-24-9
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Formula:
C22H22N2O5
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Chemical Name:
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-one
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Synonyms:
900277-24-9;(Z)-2-(benzo[d][1,3]dioxol-5-ylmethylene)-6-hydroxy-7-((4-methylpiperazin-1-yl)methyl)benzofuran-3(2H)-one;(2Z)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-2,3-dihydro-1-benzofuran-3-one;STL034497;ZINC20533460;AKOS002292005;(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-one;ST50794777;F3385-4462;(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3(2H)-one;2-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethylene)-6-hydroxy-7-[(4-methylpiperaziny l)methyl]benzo[b]furan-3-one
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CAS No:
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-one Basic Attributes
394.4 g/mol
394.15287181 g/mol
Computed Properties
Molecular Weight:394.4
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:394.15287181
Monoisotopic Mass:394.15287181
Topological Polar Surface Area:71.5
Heavy Atom Count:29
Complexity:647
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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