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3-acetyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
3-acetyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
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![3-acetyl-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/c5e80017b9694c1cbfbf9ba6b90446f3.png "3-acetyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide")
3-acetyl-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:
730254-50-9
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Formula:
C21H22N4O3S
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Chemical Name:
3-acetyl-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:
ZINC3297462;AKOS034375428;MCULE-1255570126;Z45717376;3-acetyl-N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)benzene-1-sulfonamide;730254-50-9
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CAS No:
3-acetyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide Basic Attributes
410.5 g/mol
410.14126175 g/mol
Computed Properties
Molecular Weight:410.5
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:410.14126175
Monoisotopic Mass:410.14126175
Topological Polar Surface Area:102
Heavy Atom Count:29
Complexity:672
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-acetyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
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