2-methoxy-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-methoxy-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/20220812/e970ba2bb4664c6db26aef07b4875160.png "2-methoxy-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide")
2-methoxy-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:
749918-02-3
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Formula:
C20H22N4O3S
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Chemical Name:
2-methoxy-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:
SMR000153092;MLS000565979;MLS002635611;CHEMBL1596938;HMS2179K19;ZINC2655250;NSC744375;AKOS034375433;MCULE-9312218294;NSC-744375;SR-01000053419;SR-01000053419-1;Z45717400;2-methoxy-N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)benzene-1-sulfonamide;749918-02-3
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CAS No:
2-methoxy-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzenesulfonamide Basic Attributes
398.5 g/mol
398.14126175 g/mol
744375
Computed Properties
Molecular Weight:398.5
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:398.14126175
Monoisotopic Mass:398.14126175
Topological Polar Surface Area:94.5
Heavy Atom Count:28
Complexity:603
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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