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N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide
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![N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1dbf8d51f2b64f7587788790cf7dea41.png "N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide")
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide
structure -
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CAS No:
522640-00-2
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Formula:
C21H20N4O3
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Chemical Name:
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide
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Synonyms:
ZINC3249770;AKOS033992809;MCULE-4402338713;Z27146116;522640-00-2;N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
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CAS No:
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide Basic Attributes
376.4 g/mol
376.15354051 g/mol
Computed Properties
Molecular Weight:376.4
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:376.15354051
Monoisotopic Mass:376.15354051
Topological Polar Surface Area:78.3
Heavy Atom Count:28
Complexity:554
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide
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