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1-[(2R,4S,5R)-4-ethylsulfanyl-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

1-[(2R,4S,5R)-4-ethylsulfanyl-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione structure

CAS No:
70465-86-0
Formula:
C12H18N2O4S
Chemical Name:
1-[(2R,4S,5R)-4-ethylsulfanyl-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Synonyms:
3'-SEt-ddT;Thymidine, 3'-S-ethyl-3'-thio-;3'-Ethylthio-2',3'-dideoxythymidine;CHEMBL3229812;70465-86-0;DTXSID30220739;BDBM50000982;1-[(2R,4S,5R)-4-ethylsulfanyl-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione;1-[(2R,4S,5R)-4-ethylsulfanyl-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione

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1-[(2R,4S,5R)-4-ethylsulfanyl-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione Basic Attributes

Molecular Weight：

286.35 g/mol

Exact Mass：

286.09872823 g/mol

DSSTox ID：

DTXSID30220739

Characteristics

PSA：

104 Å²

Computed Properties

Molecular Weight:286.35
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:286.09872823
Monoisotopic Mass:286.09872823
Topological Polar Surface Area:104
Heavy Atom Count:19
Complexity:413
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(2R,4S,5R)-4-ethylsulfanyl-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Basic Attributes
Characteristics
Computed Properties

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