(5E)-2-(4-bromophenyl)-5-[[4-(diethylamino)phenyl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
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![(5E)-2-(4-bromophenyl)-5-[[4-(diethylamino)phenyl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8ab81128c9904d5b867d4688330bc6c8.png "(5E)-2-(4-bromophenyl)-5-[[4-(diethylamino)phenyl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one")
(5E)-2-(4-bromophenyl)-5-[[4-(diethylamino)phenyl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
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CAS No:
606949-23-9
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Formula:
C21H19BrN4OS
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Chemical Name:
(5E)-2-(4-bromophenyl)-5-[[4-(diethylamino)phenyl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
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Synonyms:
(5E)-2-(4-bromophenyl)-5-[4-(diethylamino)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one;STK814475;ZINC16731401;AKOS002195377;2-(4-Bromophenyl)-5-(4-(diethylamino)benzylidene)thiazolo[3,2-b][1,2,4]triazol-6(5H)-one;606949-23-9
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CAS No:
(5E)-2-(4-bromophenyl)-5-[[4-(diethylamino)phenyl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one Basic Attributes
455.4 g/mol
454.04629 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:455.4
XLogP3:5.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:454.04629
Monoisotopic Mass:454.04629
Topological Polar Surface Area:76.3
Heavy Atom Count:28
Complexity:583
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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