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[2-(2-nitrophenyl)sulfanyl-3-oxocyclohexen-1-yl] 3,4-dimethoxybenzoate

[2-(2-nitrophenyl)sulfanyl-3-oxocyclohexen-1-yl] 3,4-dimethoxybenzoate structure

CAS No:
305854-29-9
Formula:
C21H19NO7S
Chemical Name:
[2-(2-nitrophenyl)sulfanyl-3-oxocyclohexen-1-yl] 3,4-dimethoxybenzoate
Synonyms:
Oprea1_277855;ZINC3177586;AKOS001014500;MCULE-5091665434;Z56769072;2-[(2-nitrophenyl)sulfanyl]-3-oxocyclohex-1-en-1-yl 3,4-dimethoxybenzoate;305854-29-9

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[2-(2-nitrophenyl)sulfanyl-3-oxocyclohexen-1-yl] 3,4-dimethoxybenzoate Basic Attributes

Molecular Weight：

429.4 g/mol

Exact Mass：

429.08822312 g/mol

Characteristics

PSA：

133 Å²

Computed Properties

Molecular Weight:429.4
XLogP3:4.1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:429.08822312
Monoisotopic Mass:429.08822312
Topological Polar Surface Area:133
Heavy Atom Count:30
Complexity:689
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(2-nitrophenyl)sulfanyl-3-oxocyclohexen-1-yl] 3,4-dimethoxybenzoate

Basic Attributes
Characteristics
Computed Properties
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