N-(4-bromo-2-fluorophenyl)-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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N-(4-bromo-2-fluorophenyl)-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
structure -
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CAS No:
578000-31-4
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Formula:
C21H14BrClFN5OS
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Chemical Name:
N-(4-bromo-2-fluorophenyl)-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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Synonyms:
ZINC2365897;STK727687;AKOS002190944;MCULE-6850873657;N-(4-bromo-2-fluorophenyl)-2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide;ST50085392;578000-31-4;N-(4-bromo-2-fluorophenyl)-2-[4-(4-chlorophenyl)-5-(4-pyridyl)(1,2,4-triazol-3 -ylthio)]acetamide
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CAS No:
N-(4-bromo-2-fluorophenyl)-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Basic Attributes
518.8 g/mol
516.97750 g/mol
Computed Properties
Molecular Weight:518.8
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:516.97750
Monoisotopic Mass:516.97750
Topological Polar Surface Area:98
Heavy Atom Count:31
Complexity:596
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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