[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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![[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d8411e73b9a34cb8a9507706fc0d5780.png "[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate")
[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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CAS No:
402762-93-0
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Formula:
C22H22ClNO4S
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Chemical Name:
[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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Synonyms:
ZINC3273402;AKOS033642977;MCULE-5798246528;Z18785284;[(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 3-chloro-1-benzothiophene-2-carboxylate;402762-93-0
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CAS No:
[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate Basic Attributes
431.9 g/mol
431.0958071 g/mol
Computed Properties
Molecular Weight:431.9
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:431.0958071
Monoisotopic Mass:431.0958071
Topological Polar Surface Area:92.9
Heavy Atom Count:29
Complexity:596
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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