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1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide
1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide
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![1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cac61be912fb4f2e978eebd90f61f6a2.png "1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide")
1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide
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CAS No:
851469-06-2
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Formula:
C22H23N7O
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Chemical Name:
1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide
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Synonyms:
ZINC3354405;AKOS033992730;MCULE-9743190197;Z27145388;1-ethyl-N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)-1H-1,2,3-benzotriazole-5-carboxamide;851469-06-2
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CAS No:
1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide Basic Attributes
401.5 g/mol
401.19640838 g/mol
Computed Properties
Molecular Weight:401.5
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:401.19640838
Monoisotopic Mass:401.19640838
Topological Polar Surface Area:90.5
Heavy Atom Count:30
Complexity:596
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-ethyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzotriazole-5-carboxamide
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