3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine

Basic Information

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CAS Number

53-79-2

Molecular Formula

C22H29N7O5

Molecular Weight

471.52 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 Amines

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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

175.5-177°

Boiling Point

572.65°C (rough estimate)

Water Solubility

Soluble in water (50 mg/ml at 20°C).

Refractive Index

1.7010 (estimate)

Specific Rotation

D25 -11° (ethanol)

SMILES

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CN(C)C1=NC=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)NC(=O)[C@H](CC4=CC=C(C=C4)OC)N)O

InChI

InChI=1S/C22H29N7O5/c1-28(2)19-17-20(25-10-24-19)29(11-26-17)22-18(31)16(15(9-30)34-22)27-21(32)14(23)8-12-4-6-13(33-3)7-5-12/h4-7,10-11,14-16,18,22,30-31H,8-9,23H2,1-3H3,(H,27,32)/t14-,15+,16+,18+,22+/m0/s1

InChIKey

RXWNCPJZOCPEPQ-NVWDDTSBSA-N

LogP

-0.7936999999999974

pKa

6.8, 7.2(at 25℃)

Topological Polar Surface Area

160.88 Å²

Hydrogen Bond Donor/Acceptor

5 / 12

Safety Information

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Hazard Class

Class 6.1(b) Class 6.1(b)

Toxicity

LD50 in mice (mg/kg): 350 i.v.; 525 i.p.; 675 orally (Porter, 1952)

Synonyms & References

English

PUROMYCIN
(s)-3’-((2-amino-3-(4-methoxyphenyl)-1-oxopropyl)amino)-3’-deoxy-n,n-dimethy
1-mm
3’-(alpha-amino-p-methoxyhydrocinnamamido)-3’-deoxy-n,n-dimethyl-adenosinl
3’-(l-alpha-amino-p-methoxyhydrocinnamamido)-3’-deoxy-n,n-dimethyladenosine
6-dimethylamino-9-(3’-(p-methoxy-l-phenylalanylamino)-beta-d-ribofuranosyl)-
achromycin
achromycin(purinederivative)
Adenosine,3'-[[(2S)-2-amino-3-(4-methoxyphenyl)-1-oxopropyl]amino]-3'-deoxy-N,N-dimethyl-
CL13900
PUROMYCIN(RG)
p-638
Stylomycin
Adenosine,3'-(a-amino-p-methoxyhydrocinnamamido)-3'-deoxy-N,N-dimethyl-,L- (8CI)
Adenosine,3'-[[2-amino-3-(4-methoxyphenyl)-1-oxopropyl]amino]-3'-deoxy-N,N-dimethyl-,(S)-
3'-(a-Amino-p-methoxyhydrocinnamamido)-3'-deoxy-N,N-dimethyladenosine
6-Dimethylamino-9-[3-deoxy-3-(p-methoxy-L-phenylalanylamino)-b-D-ribofuranosyl]-b-purine
P 638
Stillomycin
b-D-Ribofuranoside,6-(dimethylamino)-9H-purine-9 3-deoxy-3-[(4-methoxy-L-phenylalanyl)amino]-

MDL Number

MFCD00866328

FAQ

What regulatory guidelines apply to 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2)?

Regulatory guidelines for 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2) include GHS classification, REACH regulations, and FDA/EPA related requirements. It is classified as a chemical substance with potential health and environmental hazards. Manufacturers and distributors must comply with these regulations to ensure safety and compliance during production, storage, and disposal.

Are there alternatives to 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2) in synthesis?

Alternatives to 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2) in synthesis include related analogs and isomers. Common alternative reagents, such as 3'-Deoxy-3'-[(O-methyl-L-tyrosyl)amino]-guanosine, can be used as substitutes depending on the specific requirements of the synthesis. These alternatives can offer similar functionalities while potentially differing in reactivity and stability.

What is the market or research trend for 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2)?

The market and research trends for 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2) show increasing interest in its potential applications in pharmaceuticals and biotechnology. Emerging research fields include its use as a precursor in the synthesis of nucleoside analogs for antiviral and anticancer drugs. The demand for this compound is growing as it offers unique chemical properties and biological activities.

How should waste containing 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2) be handled?

Waste containing 3'-Deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine (CAS: 53-79-2) should be collected and disposed of according to local and international hazardous waste management regulations. Collection should be done in appropriate containers, sealed, and labeled with the correct hazardous waste symbols. Disposal methods include incineration, professional waste disposal services, and environmental protection precautions to prevent contamination of soil and water. Always consult local environmental protection guidelines for specific handling instructions.