[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate
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![[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3fcb2614504247679dc9b18914e4b2cb.png "[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate")
[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate
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CAS No:
787555-26-4
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Formula:
C22H18N4O5S
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Chemical Name:
[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate
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Synonyms:
ZINC3303141;AKOS002486493;MCULE-3473580306;Z18834749;2-(6-amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-oxoethyl 2-[(2-cyanophenyl)sulfanyl]benzoate;787555-26-4
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CAS No:
[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate Basic Attributes
450.5 g/mol
450.09979086 g/mol
Computed Properties
Molecular Weight:450.5
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:450.09979086
Monoisotopic Mass:450.09979086
Topological Polar Surface Area:159
Heavy Atom Count:32
Complexity:879
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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