4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 3-nitrobenzoate
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4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 3-nitrobenzoate
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CAS No:
669715-81-5
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Formula:
C18H12N4O5S
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Chemical Name:
4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 3-nitrobenzoate
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Synonyms:
4-{[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl 3-nitrobenzoate;ZINC2194486;STK177472;AKOS003310770;MCULE-4462402793;669715-81-5
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CAS No:
4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 3-nitrobenzoate Basic Attributes
396.4 g/mol
396.05284067 g/mol
Computed Properties
Molecular Weight:396.4
XLogP3:2.6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:396.05284067
Monoisotopic Mass:396.05284067
Topological Polar Surface Area:149
Heavy Atom Count:28
Complexity:610
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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