Oxathiolan 5IC-.b.
TL;DR: Oxathiolan 5IC-.b. (CAS 137530-44-0) is a chemical compound with molecular formula C8H10IN3O3S and molecular weight 354.94876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-5-iodopyrimidin-2-one
Also Known As: Oxathiolan 5IC-.b., Oxathiolan, 5IC-(+)-beta, 5-I SddC, 5-ISddC, Oxathiolan, 5IC-(+).b., 2'-Deoxy-5-iodo-3'-thiacytidine
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H10IN3O3S |
| Molecular Weight | 354.94876 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.94876 Da |
| Heavy Atoms | 16 |
| Complexity | 374.0 |
| SMILES | C1[C@@H](O[C@@H](S1)CO)N2C=C(C(=NC2=O)N)I |
| InChIKey | DPXBMYJQASAVRO-RITPCOANSA-N |
Chemical Property Profile of Oxathiolan 5IC-.b.
Property Insights of Oxathiolan 5IC-.b.
The XLogP value of -0.3 indicates that Oxathiolan 5IC-.b. is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxathiolan 5IC-.b.. Following Lipinski's Rule of Five, Oxathiolan 5IC-.b. has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Oxathiolan 5IC-.b.?
The CAS number of Oxathiolan 5IC-.b. is 137530-44-0.
What is the molecular formula of Oxathiolan 5IC-.b.?
The molecular formula of Oxathiolan 5IC-.b. is C8H10IN3O3S.
What is the molecular weight of Oxathiolan 5IC-.b.?
The molecular weight of Oxathiolan 5IC-.b. is 354.94876 g/mol.
Where can I buy Oxathiolan 5IC-.b.?
You can request a quote for Oxathiolan 5IC-.b. directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Oxathiolan 5IC-.b.?
Yes, CoreyChem provides custom synthesis services for Oxathiolan 5IC-.b. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.