3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine
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![3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/fe300a28eb4c400c857dfee05121770e.png "3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine")
3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine
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CAS No:
561009-07-2
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Formula:
C16H14N6O4S
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Chemical Name:
3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine
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Synonyms:
MLS000516530;CHEMBL1415657;HMS2628E07;ZINC3337462;AKOS033692414;MCULE-7690092585;SMR000342611;Z19579265;3-{[(6-nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl]sulfanyl}-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine;561009-07-2
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CAS No:
3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine Basic Attributes
386.4 g/mol
386.07972412 g/mol
Computed Properties
Molecular Weight:386.4
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:386.07972412
Monoisotopic Mass:386.07972412
Topological Polar Surface Area:159
Heavy Atom Count:27
Complexity:526
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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