3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-4-amine
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![3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-4-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/829355d95f6042c5b6463abad8fdde14.png "3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-4-amine")
3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-4-amine
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CAS No:
676643-35-9
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Formula:
C17H16F2N4O2S
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Chemical Name:
3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-4-amine
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Synonyms:
676643-35-9;C17H16F2N4O2S;ZINC2233697;STL298731;AKOS002188560;MCULE-9617176983;ST50084366;3-((2,6-Difluorobenzyl)thio)-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-4-amine;3-((2,6-DIFLUOROBENZYL)THIO)-5-(3,4-DIMETHOXYPHENYL)-4H-1,2,4-TRIAZOL-4-YLAMINE;3-[(2,6-difluorobenzyl)sulfanyl]-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-4-amine;3-[(2,6-difluorophenyl)methylthio]-5-(3,4-dimethoxyphenyl)-1,2,4-triazole-4-yl amine
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CAS No:
3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-4-amine Basic Attributes
378.4 g/mol
378.09620326 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:378.4
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:378.09620326
Monoisotopic Mass:378.09620326
Topological Polar Surface Area:101
Heavy Atom Count:26
Complexity:443
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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