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2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
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![2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0ee60d470ebc46c3a267601f86f331d9.png "2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide")
2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
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CAS No:
730251-12-4
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Formula:
C19H19N5O4S
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Chemical Name:
2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
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Synonyms:
ZINC3295873;AKOS008010929;MCULE-1044983387;SR-01000041120;SR-01000041120-1;Z45717342;2-nitro-N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)benzene-1-sulfonamide;730251-12-4
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CAS No:
2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide Basic Attributes
413.5 g/mol
413.11577528 g/mol
Computed Properties
Molecular Weight:413.5
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:413.11577528
Monoisotopic Mass:413.11577528
Topological Polar Surface Area:131
Heavy Atom Count:29
Complexity:671
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-nitro-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
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