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4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione

4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione structure

CAS No:
728035-14-1
Formula:
C18H17N3O4S
Chemical Name:
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione
Synonyms:
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(3,5-dimethoxyphenyl)-4H-1,2,4-triazole-3-thiol;MLS000674203;CHEMBL1449618;HMS2592M04;ZINC5795978;STK782215;STK847791;AKOS005628100;AKOS024289444;MCULE-8582082691;SMR000297119;SR-01000302958;SR-01000302958-1;4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(3,5-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione;4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5-(3,5-dimethoxyphenyl)-4H-1,2,4-triazole-3-thiol;728035-14-1

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4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Basic Attributes

Molecular Weight：

371.4 g/mol

Exact Mass：

371.09397721 g/mol

Characteristics

PSA：

96.6 Å²

Computed Properties

Molecular Weight:371.4
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:371.09397721
Monoisotopic Mass:371.09397721
Topological Polar Surface Area:96.6
Heavy Atom Count:26
Complexity:549
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione

Basic Attributes
Characteristics
Computed Properties

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