 Home > Encyclopedia > diethyl 3-methyl-5-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate

diethyl 3-methyl-5-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate

diethyl 3-methyl-5-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate structure

CAS No:
300556-32-5
Formula:
C21H20N4O5S3
Chemical Name:
diethyl 3-methyl-5-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate
Synonyms:
300556-32-5;2,4-diethyl 3-methyl-5-(2-{7-thia-2,4,5-triazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),3,5,9,11-pentaen-3-ylsulfanyl}acetamido)thiophene-2,4-dicarboxylate;diethyl 3-methyl-5-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetyl]amino}thiophene-2,4-dicarboxylate;diethyl 5-(2-(benzo[4,5]thiazolo[2,3-c][1,2,4]triazol-3-ylthio)acetamido)-3-methylthiophene-2,4-dicarboxylate;ZINC3177675;STL307072;AKOS001014397;MCULE-7990274098;diethyl 3-methyl-5-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate;ST50133848;F0307-0396;ethyl 5-(ethoxycarbonyl)-2-(2-(4-hydro-1,2,4-triazolo[3,4-b]benzothiazol-3-ylt hio)acetylamino)-4-methylthiophene-3-carboxylate

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diethyl 3-methyl-5-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate Basic Attributes

Molecular Weight：

504.6 g/mol

Exact Mass：

504.05958327 g/mol

Characteristics

PSA：

194 Å²

Computed Properties

Molecular Weight:504.6
XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:504.05958327
Monoisotopic Mass:504.05958327
Topological Polar Surface Area:194
Heavy Atom Count:33
Complexity:747
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of diethyl 3-methyl-5-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate

Basic Attributes
Characteristics
Computed Properties
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