2-phenanthro[9,10-e][1,2,4]triazin-3-ylsulfanylacetic acid
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![2-phenanthro[9,10-e][1,2,4]triazin-3-ylsulfanylacetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0a6351a1defd46adbc96b5912341ceeb.png "2-phenanthro[9,10-e][1,2,4]triazin-3-ylsulfanylacetic acid")
2-phenanthro[9,10-e][1,2,4]triazin-3-ylsulfanylacetic acid
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CAS No:
75616-92-1
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Formula:
C17H11N3O2S
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Chemical Name:
2-phenanthro[9,10-e][1,2,4]triazin-3-ylsulfanylacetic acid
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Synonyms:
NSC327704;NSC-327704;75616-92-1;NCIStruc1_001721;NCIStruc2_001584;CHEMBL1366085;SCHEMBL13659226;BDBM25463;DTXSID60318239;ZINC1573831;CCG-37064;NCGC00014760;NCI327704;NCGC00014760-02;NCGC00097861-01;NCI60_002845;2-(1,2,4-triazatriphenylen-3-ylsulfanyl)acetic acid;(phenanthro[9,10-e][1,2,4]triazin-3-ylthio)acetic acid
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CAS No:
2-phenanthro[9,10-e][1,2,4]triazin-3-ylsulfanylacetic acid Basic Attributes
321.4 g/mol
321.05719778 g/mol
327704
DTXSID60318239
Computed Properties
Molecular Weight:321.4
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:321.05719778
Monoisotopic Mass:321.05719778
Topological Polar Surface Area:101
Heavy Atom Count:23
Complexity:450
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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