Home
>
Encyclopedia
>
2,5-dimethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
2,5-dimethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
-
![2,5-dimethyl-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/ad517fdae0934ff9af0080b39be2c195.png "2,5-dimethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide")
2,5-dimethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
structure -
-
CAS No:
732988-87-3
-
Formula:
C21H24N4O2S
-
Chemical Name:
2,5-dimethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
-
Synonyms:
ZINC3305072;AKOS034375427;MCULE-6881823453;Z45717372;2,5-dimethyl-N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)benzene-1-sulfonamide;732988-87-3
-
CAS No:
2,5-dimethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide Basic Attributes
396.5 g/mol
396.16199719 g/mol
Computed Properties
Molecular Weight:396.5
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:396.16199719
Monoisotopic Mass:396.16199719
Topological Polar Surface Area:85.3
Heavy Atom Count:28
Complexity:614
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2,5-dimethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide
Request for Quotation