1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
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![1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7db82ad209224453a551db756ac57748.png "1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione")
1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
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CAS No:
108895-43-8
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Formula:
C12H18N2O5S
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Chemical Name:
1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
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Synonyms:
3'-SCH2CH2OH-ddT;3'-Hydroxyethylthio-2',3'-dideoxythymidine;Thymidine, 3'-S-(2-hydroxyethyl)-3'-thio-;108895-43-8;NSC700462;NSC 700462;DTXSID10148760;1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione;1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione;2,4(1H,3H)-Pyrimidinedione, 1-[2-deoxy-3-S-(2-hydroxyethyl)-3-thio-beta-D-erythro-pentofuranosyl]-5-methyl-
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CAS No:
1-[(2R,4S,5R)-4-(2-hydroxyethylsulfanyl)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione Basic Attributes
302.35 g/mol
302.09364285 g/mol
DTXSID10148760
Computed Properties
Molecular Weight:302.35
XLogP3:-0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:302.09364285
Monoisotopic Mass:302.09364285
Topological Polar Surface Area:124
Heavy Atom Count:20
Complexity:428
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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