2-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-4-(3-morpholin-4-ylpropyliminomethyl)isoquinolin-1-one
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2-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-4-(3-morpholin-4-ylpropyliminomethyl)isoquinolin-1-one
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CAS No:
728907-52-6
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Formula:
C25H27N3O5
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Chemical Name:
2-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-4-(3-morpholin-4-ylpropyliminomethyl)isoquinolin-1-one
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Synonyms:
MLS001033058;CHEMBL1484545;HMS2708D16;AKOS034157408;MCULE-9355958418;SMR000385478;SR-01000040072;SR-01000040072-1;Z31276643;2-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)-1,2,3,4-tetrahydroisoquinoline-1,3-dione;728907-52-6
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CAS No:
2-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-4-(3-morpholin-4-ylpropyliminomethyl)isoquinolin-1-one Basic Attributes
449.5 g/mol
449.19507097 g/mol
Computed Properties
Molecular Weight:449.5
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:449.19507097
Monoisotopic Mass:449.19507097
Topological Polar Surface Area:83.8
Heavy Atom Count:33
Complexity:750
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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