1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione

Basic Information

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CAS Number

3424-98-4

Molecular Formula

C10H14N2O5

Molecular Weight

242.23 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

Basic Physical Properties

Melting Point

188-190°C

Boiling Point

°Cat760mmHg

Density

1.452

Solubility

H2O: soluble10mg/mL (clear solution)

Refractive Index

1.584

Specific Rotation

D20 -20.3° (c = 0.192 in water)

SMILES

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CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O

InChI

InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m1/s1

InChIKey

IQFYYKKMVGJFEH-CSMHCCOUSA-N

LogP

-1.5142799999999992

Topological Polar Surface Area

104.54999999999998 Å²

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

381

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

TELBIVUDINE [MI]
DTXSID30187813
MFCD02683612
1-(2-Deoxy-beta-L-erythropentafuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione
BP-58605
AS-35209
DB01265
TELBIVUDINE [EMA EPAR]
Thymine, 1-(2-deoxy-beta-L-erythro-pentofuranosyl)-
Telbivudin
TELBIVUDINE [VANDF]
TELBIVUDINE (MART.)
IQFYYKKMVGJFEH-CSMHCCOUSA-N
CCG-266887
L-Deoxythymidine
LDT600
1-((2S,4S,5S)-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione
Thymine, 1-(2-deoxy-.beta.-L-erythro-pentofuranosyl)-
1-[(2R,4R,5S)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
2OC4HKD3SF
2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-
NS00001939
TELBIVUDINE [WHO-DD]
NCGC00346560-06
SW220236-1
Z1546610488
UNII-2OC4HKD3SF
D06675
AB01274717-01
BRD-K15976406-001-01-7
Telbivudine

MDL Number

MFCD02683612

FAQ

What is 1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4)?

1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4) is a nucleoside analog with the molecular formula C10H13N2O5. It features a pyrimidine ring with a methyl group at the 5-position, linked to a 2-deoxyribose sugar. This compound is known for its structural similarity to thymidine, making it relevant in nucleic acid research and pharmaceutical development. Its chemical properties include solubility in polar solvents and stability under controlled conditions.

What are the main uses of 1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4)?

1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4) is primarily used in pharmaceutical research as a potential antiviral or anticancer agent. It serves as a building block in the synthesis of nucleotide-based drugs and is also employed in biochemical studies to investigate DNA/RNA structure and function. Additionally, it may find applications in biotechnology for nucleic acid modification and labeling processes.

Is 1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4) safe?

1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4) is generally considered safe when handled according to standard chemical safety protocols. However, it may cause skin or eye irritation upon contact. Safety data sheets (SDS) recommend using personal protective equipment (PPE) like gloves and goggles. While it is not classified as toxic or carcinogenic, prolonged exposure should be avoided, and proper ventilation is advised during handling.

How should 1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4) be stored?

1-(2-Deoxy-beta-L-erythro-pentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione (CAS: 3424-98-4) should be stored in a tightly sealed container in a cool, dry place, away from light and moisture. Maintain storage conditions between 2-8°C and ensure humidity levels remain below 50%. Avoid exposure to air and heat to preserve stability. Always follow manufacturer guidelines for long-term storage and handling.