2-[[2-methoxy-5-[(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenyl]methyl]isoindole-1,3-dione
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![2-[[2-methoxy-5-[(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenyl]methyl]isoindole-1,3-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/af7088cb02a84d09840183dca5a69118.png "2-[[2-methoxy-5-[(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenyl]methyl]isoindole-1,3-dione")
2-[[2-methoxy-5-[(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenyl]methyl]isoindole-1,3-dione
structure -
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CAS No:
372496-01-0
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Formula:
C28H21N3O6S
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Chemical Name:
2-[[2-methoxy-5-[(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenyl]methyl]isoindole-1,3-dione
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Synonyms:
STL039356;ZINC97969063;AKOS005693062;AKOS030508808;(Z)-2-(2-methoxy-5-((1-(3-methoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzyl)isoindoline-1,3-dione;2-(2-methoxy-5-{(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzyl)-1H-isoindole-1,3(2H)-dione;372496-01-0
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CAS No:
2-[[2-methoxy-5-[(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenyl]methyl]isoindole-1,3-dione Basic Attributes
527.5 g/mol
527.11510657 g/mol
Computed Properties
Molecular Weight:527.5
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:527.11510657
Monoisotopic Mass:527.11510657
Topological Polar Surface Area:137
Heavy Atom Count:38
Complexity:1010
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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