2-(1,3-benzodioxol-5-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-yliminomethyl)-3-hydroxyisoquinolin-1-one
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2-(1,3-benzodioxol-5-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-yliminomethyl)-3-hydroxyisoquinolin-1-one
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CAS No:
731004-81-2
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Formula:
C25H18N2O6
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Chemical Name:
2-(1,3-benzodioxol-5-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-yliminomethyl)-3-hydroxyisoquinolin-1-one
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Synonyms:
AKOS034157161;MCULE-7908886028;Z31270872;2-(2H-1,3-benzodioxol-5-yl)-4-{[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]methylidene}-1,2,3,4-tetrahydroisoquinoline-1,3-dione;731004-81-2
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CAS No:
2-(1,3-benzodioxol-5-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-yliminomethyl)-3-hydroxyisoquinolin-1-one Basic Attributes
442.4 g/mol
442.11648630 g/mol
Computed Properties
Molecular Weight:442.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:442.11648630
Monoisotopic Mass:442.11648630
Topological Polar Surface Area:89.8
Heavy Atom Count:33
Complexity:815
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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