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(2S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-3-carbonitrile

(2S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-3-carbonitrile structure

CAS No:
118222-08-5
Formula:
C11H11N3O4
Chemical Name:
(2S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-3-carbonitrile
Synonyms:
3'-CN-D4T;3'-C-Cyano-3'-deoxy-2',3'-didehydrothymidine;118222-08-5;3-Furancarbonitrile, 5-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)-2,5-dihydro-2-(hydroxymethyl)-, (2S,5R)-;DTXSID50152043;(2S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-3-carbonitrile

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(2S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-3-carbonitrile Basic Attributes

Molecular Weight：

249.22 g/mol

Exact Mass：

249.07495584 g/mol

DSSTox ID：

DTXSID50152043

Characteristics

PSA：

103 Å²

Computed Properties

Molecular Weight:249.22
XLogP3:-1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:249.07495584
Monoisotopic Mass:249.07495584
Topological Polar Surface Area:103
Heavy Atom Count:18
Complexity:514
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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