2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
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2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
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CAS No:
679425-18-4
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Formula:
C22H25N5O3S
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Chemical Name:
2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
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Synonyms:
ZINC3312414;AKOS001043130;MCULE-9904626147;ST50132145;AB00715400-01;Z16577089;2-{[4-amino-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide;679425-18-4;N-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-2-{4-amino-5-[4-(tert-butyl)phenyl](1,2, 4-triazol-3-ylthio)}acetamide
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CAS No:
2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Basic Attributes
439.5 g/mol
439.16781085 g/mol
Computed Properties
Molecular Weight:439.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:439.16781085
Monoisotopic Mass:439.16781085
Topological Polar Surface Area:130
Heavy Atom Count:31
Complexity:610
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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