3-甲基胸苷
TL;DR: 3-甲基胸苷 (CAS 958-74-7) is a chemical compound with molecular formula C11H16N2O5 and molecular weight 256.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲基胸苷
1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dimethylpyrimidine-2,4-dione
Also Known As: 3-Methylthymidine, Methylthymidine, N3-Methylthymidine, BIM-0022228.P001, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dimethylpyrimidine-2,4-dione
| Molecular Formula | C11H16N2O5 |
|---|---|
| Molecular Weight | 256.11 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 90.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.10593 |
| Heavy Atoms | 18 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 958-74-7 |
|---|---|
| SMILES | CC1=CN(C(=O)N(C1=O)C)C2CC(C(O2)CO)O |
| InChIKey | JCVDICFLPGDHAT-UHFFFAOYSA-N |
Product Overview
3-甲基胸苷 (CAS 958-74-7), with molecular formula C11H16N2O5 and molecular weight 256.11 g/mol. IUPAC: 1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 3-甲基胸苷
Property Insights of 3-甲基胸苷
The XLogP value of -1.0 indicates that 3-甲基胸苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-甲基胸苷. Following Lipinski's Rule of Five, 3-甲基胸苷 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-甲基胸苷?
The CAS number of 3-甲基胸苷 is 958-74-7.
What is the molecular formula of 3-甲基胸苷?
The molecular formula of 3-甲基胸苷 is C11H16N2O5.
What is the molecular weight of 3-甲基胸苷?
The molecular weight of 3-甲基胸苷 is 256.11 g/mol.
Where can I buy 3-甲基胸苷?
You can request a quote for 3-甲基胸苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基胸苷?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基胸苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.