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4-benzyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole

4-benzyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole structure

CAS No:
561024-44-0
Formula:
C22H18N4O4S2
Chemical Name:
4-benzyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole
Synonyms:
ZINC2618261;AKOS033339450;MCULE-9118412324;Z14341886;4-benzyl-3-{[(6-nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl]sulfanyl}-5-(thiophen-2-yl)-4H-1,2,4-triazole;561024-44-0

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4-benzyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Basic Attributes

Molecular Weight：

466.5 g/mol

Exact Mass：

466.07694742 g/mol

Characteristics

PSA：

149 Å²

Computed Properties

Molecular Weight:466.5
XLogP3:4.1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:466.07694742
Monoisotopic Mass:466.07694742
Topological Polar Surface Area:149
Heavy Atom Count:32
Complexity:636
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-benzyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole

Basic Attributes
Characteristics
Computed Properties

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