N-Benzoyladenosine

Basic Information

View in Editor

CAS Number

4546-55-8

Molecular Formula

C17H17N5O5

Molecular Weight

371.35 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

153°C

Refractive Index

-48 ° (C=1, DMSO)

Specific Rotation

-49 º (c=1% in DMSO)

SMILES

View in Editor

C1=CC=C(C=C1)C(=O)NC2=C3C(=NC=N2)N(C=N3)C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C17H17N5O5/c23-6-10-12(24)13(25)17(27-10)22-8-20-11-14(18-7-19-15(11)22)21-16(26)9-4-2-1-3-5-9/h1-5,7-8,10,12-13,17,23-25H,6H2,(H,18,19,21,26)/t10-,12-,13-,17-/m1/s1

InChIKey

NZDWTKFDAUOODA-CNEMSGBDSA-N

LogP

-0.3099000000000008

Topological Polar Surface Area

142.62 Å²

Hydrogen Bond Donor/Acceptor

4 / 10

Complexity

534

Safety Information

View Safety Information

GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

NZDWTKFDAUOODA-CNEMSGBDSA-N
CHEMBL1688962
W12880
Benzamide, N-(9-beta-D-ribofuranosyl-9H-purin-6-yl)-(8CI)
n6-benzoyl-adenosine
N-Benzoyladenosine, 96%
CS-W008388
N-(9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-yl)benzamide;N6-Benzoyladenosine
6-N-Benzoyladenosine
SCHEMBL233208
N-(9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-yl)benzamide
N-{9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-yl}benzamide
4546-55-8
N-Benzoyladenosine
DTXSID10471222
AKOS015839046
N-[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
N-{9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl}-9H-purin-6-yl]benzamide
C17H17N5O5
MFCD00056988
AS-18866
Adenosine, N-benzoyl-
A826808
N-{9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-9H-purin-6-yl}benzamide
n-benzoyl adenosine
AKOS015889319
AMY3710
AC-32168
6 -N-Benzoyl adenosine
N6-Benzoyladenosine
N6 -benzoyl adenosine

MDL Number

MFCD00056988

FAQ

What is N-Benzoyladenosine (CAS: 4546-55-8)?

N-Benzoyladenosine is a chemical compound with the CAS number 4546-55-8. It is a derivative of adenine, specifically an adenine derivative where the amino group is replaced by a benzoyl group. This compound can be used in pharmaceutical research for its potential biological activities.

What are the main uses of N-Benzoyladenosine (CAS: 4546-55-8)?

N-Benzoyladenosine (CAS: 4546-55-8) is primarily used in pharmaceutical research for its potential as an adenosine receptor modulator. It can also be used as a tool compound for studying adenine derivatives and their effects on cellular processes.

Is N-Benzoyladenosine (CAS: 4546-55-8) safe?

N-Benzoyladenosine (CAS: 4546-55-8) is generally considered safe for laboratory use when proper safety measures are followed. However, it should be handled with caution, and appropriate personal protective equipment should be worn to avoid exposure. Ensure proper ventilation in the work area.

How should N-Benzoyladenosine (CAS: 4546-55-8) be stored?

N-Benzoyladenosine (CAS: 4546-55-8) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation and loss of activity. Storage at room temperature is recommended, but refrigeration may be necessary for long-term storage to maintain stability.