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

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

CAS No:
221272-62-4
Formula:
C12H14N2O5
Chemical Name:
1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Synonyms:
Thymidine, 4'-C-ethynyl-;4'-ethynylthymidine;221272-62-4;1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione;4'-alpha-Ethynylthymidine;4'-.alpha.-Ethynylthymidine;SCHEMBL913904;CHEMBL2368078;DTXSID40176652;1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione

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

Molecular Weight：

266.25 g/mol

Exact Mass：

266.09027155 g/mol

DSSTox ID：

DTXSID40176652

Characteristics

PSA：

99.1 Å²

Computed Properties

Molecular Weight:266.25
XLogP3:-1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:266.09027155
Monoisotopic Mass:266.09027155
Topological Polar Surface Area:99.1
Heavy Atom Count:19
Complexity:506
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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