2-[5-[(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid
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![2-[5-[(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/282d2094a2424d528d8dc827cc234b65.png "2-[5-[(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid")
2-[5-[(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid
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CAS No:
5999-46-2
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Formula:
C24H18N2O7
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Chemical Name:
2-[5-[(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid
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Synonyms:
2-(5-{(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid;SMSF0010935;STK177155;STK617084;ZINC18272221;AKOS000322332;AKOS005551065;BIM-0008796.P001;ST50252289;SR-01000357349;SR-01000357349-1;2-(5-{(E)-[1-(4-ethoxyphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid;2-(5-{[1-(4-ethoxyphenyl)-2,4,6-trioxo-1,3-dihydropyrimidin-5-ylidene]methyl}- 2-furyl)benzoic acid;5999-46-2
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CAS No:
2-[5-[(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid Basic Attributes
446.4 g/mol
446.11140092 g/mol
Computed Properties
Molecular Weight:446.4
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:446.11140092
Monoisotopic Mass:446.11140092
Topological Polar Surface Area:126
Heavy Atom Count:33
Complexity:818
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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