3-(4-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione
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3-(4-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione
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CAS No:
878420-86-1
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Formula:
C16H12ClN3O2S
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Chemical Name:
3-(4-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione
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Synonyms:
SMR000221456;MLS000331991;5-(4-Chloro-phenyl)-4-(2,3-dihydro-benzo[1,4]dioxin-6-yl)-4H-[1,2,4]triazole-3-thiol;CHEMBL1342993;BDBM51811;cid_2039982;HMS2550D23;ZINC5903930;STK588237;STK784171;AKOS000585734;AKOS005510815;CCG-287869;MCULE-2500937771;3-(4-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione;5-(4-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-1,2,4-triazole-3-thiol;5-(4-chlorophenyl)-4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4H-1,2,4-triazole-3-thiol;5-(4-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione;878420-86-1
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CAS No:
3-(4-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione Basic Attributes
345.8 g/mol
345.0338755 g/mol
Computed Properties
Molecular Weight:345.8
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:345.0338755
Monoisotopic Mass:345.0338755
Topological Polar Surface Area:78.2
Heavy Atom Count:23
Complexity:496
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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