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ethyl 5-amino-4-cyano-3-[4-(1,3-dioxoisoindol-2-yl)butanoyloxymethyl]thiophene-2-carboxylate

ethyl 5-amino-4-cyano-3-[4-(1,3-dioxoisoindol-2-yl)butanoyloxymethyl]thiophene-2-carboxylate structure

CAS No:
851277-87-7
Formula:
C21H19N3O6S
Chemical Name:
ethyl 5-amino-4-cyano-3-[4-(1,3-dioxoisoindol-2-yl)butanoyloxymethyl]thiophene-2-carboxylate
Synonyms:
HMS1730I20;ZINC3368459;AKOS033686222;MCULE-5783374575;SR-01000062829;SR-01000062829-1;Z19490849;851277-87-7;ethyl 5-amino-4-cyano-3-({[4-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)butanoyl]oxy}methyl)thiophene-2-carboxylate

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ethyl 5-amino-4-cyano-3-[4-(1,3-dioxoisoindol-2-yl)butanoyloxymethyl]thiophene-2-carboxylate Basic Attributes

Molecular Weight：

441.5 g/mol

Exact Mass：

441.09945651 g/mol

Characteristics

PSA：

168 Å²

Computed Properties

Molecular Weight:441.5
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:441.09945651
Monoisotopic Mass:441.09945651
Topological Polar Surface Area:168
Heavy Atom Count:31
Complexity:756
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 5-amino-4-cyano-3-[4-(1,3-dioxoisoindol-2-yl)butanoyloxymethyl]thiophene-2-carboxylate

Basic Attributes
Characteristics
Computed Properties
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