3-(3,4-dimethoxyphenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine
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![3-(3,4-dimethoxyphenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/44915c1988b0470e99121e47d0562aaa.png "3-(3,4-dimethoxyphenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine")
3-(3,4-dimethoxyphenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine
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CAS No:
577791-50-5
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Formula:
C17H17FN4O2S
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Chemical Name:
3-(3,4-dimethoxyphenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine
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Synonyms:
3-(3,4-dimethoxyphenyl)-5-[(4-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine;577791-50-5;ZINC2379959;SALOR-INT L410160-1EA;STL341434;AKOS002188617;MCULE-1343075454;ST50084370;3-(3,4-Dimethoxyphenyl)-5-((4-fluorobenzyl)thio)-4H-1,2,4-triazol-4-amine;5-(3,4-dimethoxyphenyl)-3-[(4-fluorophenyl)methylthio]-1,2,4-triazole-4-ylamin e
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CAS No:
3-(3,4-dimethoxyphenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Basic Attributes
360.4 g/mol
360.10562513 g/mol
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:360.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:360.10562513
Monoisotopic Mass:360.10562513
Topological Polar Surface Area:101
Heavy Atom Count:25
Complexity:414
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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