4-[2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]acetyl]benzonitrile
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![4-[2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]acetyl]benzonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/663cf254395e4fef8d50fb33dc6cdded.png "4-[2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]acetyl]benzonitrile")
4-[2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]acetyl]benzonitrile
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CAS No:
722482-67-9
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Formula:
C17H18N8OS
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Chemical Name:
4-[2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]acetyl]benzonitrile
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Synonyms:
ZINC3253224;AKOS034462932;CCG-288510;MCULE-8797543617;SR-01000038435;SR-01000038435-1;Z56874374;4-(2-{[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetyl)benzonitrile;722482-67-9
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CAS No:
4-[2-[[5,7-bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]acetyl]benzonitrile Basic Attributes
382.4 g/mol
382.13242840 g/mol
Computed Properties
Molecular Weight:382.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:382.13242840
Monoisotopic Mass:382.13242840
Topological Polar Surface Area:146
Heavy Atom Count:27
Complexity:546
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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