ethyl 4-[[2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
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ethyl 4-[[2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
structure -
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CAS No:
494825-95-5
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Formula:
C20H21N5O4S2
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Chemical Name:
ethyl 4-[[2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
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Synonyms:
494825-95-5;CHEMBL3808543;ZINC2351781;STK841988;AKOS001058536;MCULE-2535963412;ST50032628;Z56915348;ethyl 4-({[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)benzoate;ethyl 4-({2-[(5-{[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)benzoate;ethyl 4-(2-{5-[(4,6-dimethylpyrimidin-2-ylthio)methyl]-1,3,4-oxadiazol-2-ylthi o}acetylamino)benzoate;ethyl 4-{2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetamido}benzoate
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CAS No:
ethyl 4-[[2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]benzoate Basic Attributes
459.5 g/mol
459.10349652 g/mol
Computed Properties
Molecular Weight:459.5
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:459.10349652
Monoisotopic Mass:459.10349652
Topological Polar Surface Area:171
Heavy Atom Count:31
Complexity:584
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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