2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone
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2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone
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CAS No:
745025-86-9
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Formula:
C17H12N2O6S
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Chemical Name:
2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone
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Synonyms:
ZINC2637828;AKOS033684043;MCULE-9100735897;SR-01000051823;SR-01000051823-1;Z19455608;2-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethan-1-one;745025-86-9
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CAS No:
2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone Basic Attributes
372.4 g/mol
372.04160728 g/mol
Computed Properties
Molecular Weight:372.4
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:372.04160728
Monoisotopic Mass:372.04160728
Topological Polar Surface Area:140
Heavy Atom Count:26
Complexity:512
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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