 Home > Encyclopedia > ethyl 2-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate

ethyl 2-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate

ethyl 2-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate structure

CAS No:
477296-54-1
Formula:
C22H17N3O4S
Chemical Name:
ethyl 2-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate
Synonyms:
477296-54-1;(Z)-ethyl 2-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)benzoate;ethyl 2-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate;ETHYL 2-{[(1Z)-2-[4-(2H-1,3-BENZODIOXOL-5-YL)-1,3-THIAZOL-2-YL]-2-CYANOETH-1-EN-1-YL]AMINO}BENZOATE;ethyl 2-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate;ZINC2202196;STK844149;AKOS000607346;ST50265266;SR-01000319172;SR-01000319172-1;F0837-0281;ethyl 2-{[2-(4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)(1,3-thiazol-2-yl))(1Z)-2-cya novinyl]amino}benzoate

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ethyl 2-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate Basic Attributes

Molecular Weight：

419.5 g/mol

Exact Mass：

419.09397721 g/mol

Characteristics

PSA：

122 Å²

Computed Properties

Molecular Weight:419.5
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:419.09397721
Monoisotopic Mass:419.09397721
Topological Polar Surface Area:122
Heavy Atom Count:30
Complexity:693
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate

Basic Attributes
Characteristics
Computed Properties
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