2-(4-chlorophenyl)sulfonyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide
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![2-(4-chlorophenyl)sulfonyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/db3ebdb34df84944b58771ca02dc5b1c.png "2-(4-chlorophenyl)sulfonyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide")
2-(4-chlorophenyl)sulfonyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide
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CAS No:
744242-35-1
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Formula:
C21H21ClN4O3S
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Chemical Name:
2-(4-chlorophenyl)sulfonyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide
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Synonyms:
ZINC2635321;AKOS034469026;MCULE-5245298115;SR-01000051289;SR-01000051289-1;Z56974810;2-(4-chlorobenzenesulfonyl)-N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)acetamide;744242-35-1
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CAS No:
2-(4-chlorophenyl)sulfonyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide Basic Attributes
444.9 g/mol
444.1022894 g/mol
Computed Properties
Molecular Weight:444.9
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:444.1022894
Monoisotopic Mass:444.1022894
Topological Polar Surface Area:102
Heavy Atom Count:30
Complexity:685
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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