propan-2-yl 2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetate
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propan-2-yl 2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetate
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CAS No:
740871-54-9
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Formula:
C18H17BrN4O2S
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Chemical Name:
propan-2-yl 2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetate
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Synonyms:
740871-54-9;ZINC2259180;SALOR-INT L405809-1EA;STL338635;AKOS002192493;MCULE-8260088110;ST50085741;ISOPROPYL ((4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETATE;Isopropyl 2-((4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)acetate;methylethyl 2-[4-(4-bromophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-ylthio]acetate;propan-2-yl {[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
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CAS No:
propan-2-yl 2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetate Basic Attributes
433.3 g/mol
432.02556 g/mol
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, 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:433.3
XLogP3:3.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:432.02556
Monoisotopic Mass:432.02556
Topological Polar Surface Area:95.2
Heavy Atom Count:26
Complexity:463
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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