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ethyl 5-bromo-3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate

ethyl 5-bromo-3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate structure

CAS No:
731789-57-4
Formula:
C21H18BrN3O3S
Chemical Name:
ethyl 5-bromo-3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate
Synonyms:
ZINC3365090;AKOS033903446;MCULE-6316419546;Z24158644;731789-57-4;ethyl 5-bromo-3-{[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1-benzofuran-2-carboxylate

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ethyl 5-bromo-3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Basic Attributes

Molecular Weight：

472.4 g/mol

Exact Mass：

471.02523 g/mol

Characteristics

PSA：

95.4 Å²

Computed Properties

Molecular Weight:472.4
XLogP3:5.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:471.02523
Monoisotopic Mass:471.02523
Topological Polar Surface Area:95.4
Heavy Atom Count:29
Complexity:565
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 5-bromo-3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate

Basic Attributes
Characteristics
Computed Properties
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