N-benzoyl-2'-deoxyadenosine

CAS 305808-19-9  ·  C17H17N5O4  ·  MW 355.3 g/mol

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3D model N-benzoyl-2'-deoxyadenosine, CAS 305808-19-9, molecular formula C17H17N5O4, molar mass 355.3 g/mol
About N-benzoyl-2'-deoxyadenosine

N-benzoyl-2'-deoxyadenosine is a chemical compound registered under number CAS 305808-19-9, with the molecular formula C17H17N5O4, and a molar mass of 355.3 g/mol.

The molecule contains 43 atoms connected by 46 chemical bonds. The full systematic IUPAC name of this compound is N-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 0.2 (positive value, a lipophilic compound), polar surface area PSA = 122 Ų, 3 donors and 7 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC17H17N5O4
Masa molowa355.3 g/mol
IUPACN-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
SMILESC1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)NC(=O)C4=CC=CC=C4)CO)O
InChIKeyPIXHJAPVPCVZSV-YNEHKIRRSA-N
logP (XLogP3)0.2
PSA122 Ų
HBD / HBA3 / 7
PubChem CIDCID 107558 ↗
Scientific literature

Related literature

15 articles · 1 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (15 articles)

1909: 1 articles19091925: 1 articles1999: 1 articles2003: 1 articles2011: 1 articles20112019: 8 articles2020: 1 articles2022: 1 articles2022

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(2011) · Musing
Cytowania: 3$ PaywallDOI ↗
(1925) · Der Briefwechsel zwischen Goethe und Schiller
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Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
4546-72-9 · N-Benzoyl-2'-deoxyadenosine · N-Benzoyldeoxyadenosine · Adenosine, N-benzoyl-2'-deoxy- · EINECS 224-903-6 · RefChem:162888 · DTXCID20119007 · 224-903-6 · N6-Benzoyl-2'-deoxyadenosine · 305808-19-9 · N-Benzoyl-2'-deoxy-adenosine · N-(9-((2R,4S,5R)-4-Hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-yl)benzamide · C17H17N5O4 · MFCD00009628 · N-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
N-benzoyl-2'-deoxyadenosine — CAS 305808-19-9

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
N-benzoyl-2'-deoxyadenosine (CAS 305808-19-9) — License & Provenance

Source:
N-benzoyl-2'-deoxyadenosine (CAS 305808-19-9) — MolGod molecule record

Source data: PubChem CID 107558

STL: Download 3D model (888 KB)

SHA-256: 0c7b76f266eb01c4ca748f9b739f105175d245be5b2c921011d80dadcfbcf11a

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Source data: PubChem CID 107558

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