Thymidine, alpha-(methylsulfonyl)-
TL;DR: Thymidine, alpha-(methylsulfonyl)- (CAS 72687-18-4) is a chemical compound with molecular formula C11H16N2O7S and molecular weight 320.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(methylsulfonylmethyl)pyrimidine-2,4-dione
Also Known As: Thymidine, alpha-(methylsulfonyl)-, 1H-Inden-1-one,3-benzoyl-2-phenyl, 2'-Deoxy-5-[(methanesulfonyl)methyl]uridine, 5-[(Methylsulfonyl)methyl]-2 -deoxyuridine, 1-(2-Deoxy-ss-D-ribofuranosyl)-alpha-(methylsulfonyl)thymine
| Molecular Formula | C11H16N2O7S |
|---|---|
| Molecular Weight | 320.07 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.0678 |
| Heavy Atoms | 21 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 72687-18-4 |
|---|---|
| SMILES | CS(=O)(=O)CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O |
| InChIKey | OFUBWGLTPMSHFG-DJLDLDEBSA-N |
Product Overview
Thymidine, alpha-(methylsulfonyl)- (CAS 72687-18-4), with molecular formula C11H16N2O7S and molecular weight 320.07 g/mol. IUPAC: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(methylsulfonylmethyl)pyrimidine-2,4-dione.
Chemical Property Profile of Thymidine, alpha-(methylsulfonyl)-
Property Insights of Thymidine, alpha-(methylsulfonyl)-
The XLogP value of -2.4 indicates that Thymidine, alpha-(methylsulfonyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.0 Ų indicates high polarity, suggesting Thymidine, alpha-(methylsulfonyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thymidine, alpha-(methylsulfonyl)- has 3 hydrogen bond donor(s) and 7 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 Thymidine, alpha-(methylsulfonyl)-?
The CAS number of Thymidine, alpha-(methylsulfonyl)- is 72687-18-4.
What is the molecular formula of Thymidine, alpha-(methylsulfonyl)-?
The molecular formula of Thymidine, alpha-(methylsulfonyl)- is C11H16N2O7S.
What is the molecular weight of Thymidine, alpha-(methylsulfonyl)-?
The molecular weight of Thymidine, alpha-(methylsulfonyl)- is 320.07 g/mol.
Where can I buy Thymidine, alpha-(methylsulfonyl)-?
You can request a quote for Thymidine, alpha-(methylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thymidine, alpha-(methylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for Thymidine, alpha-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.