OxathiolanT-(+)-beta
TL;DR: OxathiolanT-(+)-beta (CAS 137623-42-8) is a chemical compound with molecular formula C9H12N2O4S and molecular weight 244.05177 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-5-methylpyrimidine-2,4-dione
Also Known As: OxathiolanT-(+)-beta, OxathiolanT-(+).b., 1,3-oxathiolane deriv., 5-Me SddU, 5-MeSddU, 2,4(1H,3H)-Pyrimidinedione, 1-(2-(hydroxymethyl)-1,3-oxathiolan-5-yl)-5-methyl-, (2S-cis)-
Technical Specifications
| Molecular Formula | C9H12N2O4S |
| Molecular Weight | 244.05177 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.05177 Da |
| Heavy Atoms | 16 |
| Complexity | 357.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2CS[C@H](O2)CO |
| InChIKey | GCMLYCFXOXELDY-RQJHMYQMSA-N |
Chemical Property Profile of OxathiolanT-(+)-beta
Property Insights of OxathiolanT-(+)-beta
The XLogP value of -0.5 indicates that OxathiolanT-(+)-beta is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for OxathiolanT-(+)-beta. Following Lipinski's Rule of Five, OxathiolanT-(+)-beta 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
What is the CAS number of OxathiolanT-(+)-beta?
The CAS number of OxathiolanT-(+)-beta is 137623-42-8.
What is the molecular formula of OxathiolanT-(+)-beta?
The molecular formula of OxathiolanT-(+)-beta is C9H12N2O4S.
What is the molecular weight of OxathiolanT-(+)-beta?
The molecular weight of OxathiolanT-(+)-beta is 244.05177 g/mol.
Where can I buy OxathiolanT-(+)-beta?
You can request a quote for OxathiolanT-(+)-beta directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for OxathiolanT-(+)-beta?
Yes, CoreyChem provides custom synthesis services for OxathiolanT-(+)-beta and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.