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2-(1,3-benzodioxol-5-yl)-4H-isoquinoline-1,3-dione

2-(1,3-benzodioxol-5-yl)-4H-isoquinoline-1,3-dione structure

CAS No:
731004-78-7
Formula:
C16H11NO4
Chemical Name:
2-(1,3-benzodioxol-5-yl)-4H-isoquinoline-1,3-dione
Synonyms:
731004-78-7;ZINC2231264;STK580171;AKOS005504102;MCULE-9492202832;Z56948589;2-(1,3-benzodioxol-5-yl)isoquinoline-1,3(2H,4H)-dione;2-(2H-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydroisoquinoline-1,3-dione

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2-(1,3-benzodioxol-5-yl)-4H-isoquinoline-1,3-dione Basic Attributes

Molecular Weight：

281.26 g/mol

Exact Mass：

281.06880783 g/mol

Characteristics

PSA：

55.8 Å²

Computed Properties

Molecular Weight:281.26
XLogP3:2.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:281.06880783
Monoisotopic Mass:281.06880783
Topological Polar Surface Area:55.8
Heavy Atom Count:21
Complexity:452
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1,3-benzodioxol-5-yl)-4H-isoquinoline-1,3-dione

Basic Attributes
Characteristics
Computed Properties

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