4-[4-[[4-(2-Chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]benzoic acid
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![4-[4-[[4-(2-Chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/bd2eb16bc114467b96e7d5b69ac47c0f.png "4-[4-[[4-(2-Chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]benzoic acid")
4-[4-[[4-(2-Chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]benzoic acid
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CAS No:
1415559-66-8
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Formula:
C22H19ClN4O6
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Chemical Name:
4-[4-[[4-(2-Chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]benzoic acid
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Synonyms:
Benzoic acid,4-[4-[[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]-;4-[4-[[4-(2-Chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]benzoic acid
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CAS No:
4-[4-[[4-(2-Chloro-4-nitrophenyl)-1-piperazinyl]carbonyl]-5-methyl-3-isoxazolyl]benzoic acid Basic Attributes
470.86246
470.86
Computed Properties
Molecular Weight:470.9
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:470.0993120
Monoisotopic Mass:470.0993120
Topological Polar Surface Area:133
Heavy Atom Count:33
Complexity:735
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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