3-[(4-bromophenyl)methylsulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-4-amine
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![3-[(4-bromophenyl)methylsulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-4-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/83cc3e876d204714a2646fcf23f413fa.png "3-[(4-bromophenyl)methylsulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-4-amine")
3-[(4-bromophenyl)methylsulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-4-amine
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CAS No:
586988-79-6
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Formula:
C18H19BrN4O3S
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Chemical Name:
3-[(4-bromophenyl)methylsulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-4-amine
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Synonyms:
ZINC2395052;STL342032;AKOS002188764;MCULE-9791004969;ST50084471;3-[(4-bromobenzyl)sulfanyl]-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-4-amine;3-[(4-bromophenyl)methylthio]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-4-ylam ine;586988-79-6
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CAS No:
3-[(4-bromophenyl)methylsulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-4-amine Basic Attributes
451.3 g/mol
450.03612 g/mol
Computed Properties
Molecular Weight:451.3
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:450.03612
Monoisotopic Mass:450.03612
Topological Polar Surface Area:110
Heavy Atom Count:27
Complexity:444
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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