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ethyl 2-[2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate

ethyl 2-[2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate structure

CAS No:
868224-02-6
Formula:
C22H21ClN2O6
Chemical Name:
ethyl 2-[2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate
Synonyms:
868224-02-6;ethyl 2-((2-(2-((5-chloro-2-methoxyphenyl)amino)-2-oxoethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy)acetate;ethyl 2-[(2-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy]acetate;ZINC2712226;AKOS024610153;MCULE-5247765309;ethyl 2-[2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate;AB00686545-01;SR-01000909174;SR-01000909174-1;F1808-0092

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ethyl 2-[2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate Basic Attributes

Molecular Weight：

444.9 g/mol

Exact Mass：

444.1088141 g/mol

Characteristics

PSA：

94.2 Å²

Computed Properties

Molecular Weight:444.9
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:444.1088141
Monoisotopic Mass:444.1088141
Topological Polar Surface Area:94.2
Heavy Atom Count:31
Complexity:687
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate

Basic Attributes
Characteristics
Computed Properties
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