methyl 4-thiophen-2-yl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate
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methyl 4-thiophen-2-yl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate
structure -
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CAS No:
379238-05-8
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Formula:
C20H14N4O3S4
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Chemical Name:
methyl 4-thiophen-2-yl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate
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Synonyms:
RCL R876925;ZINC1802689;STL305752;AKOS001049969;MCULE-8446255143;UPCMLD0ENAT0509-9862:001;ST50050008;Z56848128;379238-05-8;methyl 2-(2-(4-hydro-1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)acetylamino)-4 -(2-thienyl)thiophene-3-carboxylate;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)-[2,3'-bithiophene]-4'-carboxylate;methyl 5'-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetyl]amino}-2,3'-bithiophene-4'-carboxylate
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CAS No:
methyl 4-thiophen-2-yl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate Basic Attributes
486.6 g/mol
485.99487502 g/mol
Computed Properties
Molecular Weight:486.6
XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:485.99487502
Monoisotopic Mass:485.99487502
Topological Polar Surface Area:196
Heavy Atom Count:31
Complexity:689
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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