Lamivudine sulfoxide
TL;DR: Lamivudine sulfoxide (CAS 131086-23-2) is a chemical compound with molecular formula C8H11N3O4S and molecular weight 245.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2S,5R)-2-(hydroxymethyl)-3-oxo-1,3-oxathiolan-5-yl]pyrimidin-2-one
Also Known As: Lamivudine sulfoxide, Lamivudine-sulfoxide, Lamivudine impurity H, Lamivudine Impurity 18, 1,3-oxathiolane deriv.
| Molecular Formula | C8H11N3O4S |
|---|---|
| Molecular Weight | 245.05 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.04703 |
| Heavy Atoms | 16 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 131086-23-2 |
|---|---|
| SMILES | C1[C@@H](O[C@@H](S1=O)CO)N2C=CC(=NC2=O)N |
| InChIKey | LJMQAXFNQNADRZ-FYZWQCAOSA-N |
Product Overview
Lamivudine sulfoxide (CAS 131086-23-2), with molecular formula C8H11N3O4S and molecular weight 245.05 g/mol. IUPAC: 4-amino-1-[(2S,5R)-2-(hydroxymethyl)-3-oxo-1,3-oxathiolan-5-yl]pyrimidin-2-one.
Chemical Property Profile of Lamivudine sulfoxide
Property Insights of Lamivudine sulfoxide
The XLogP value of -2.3 indicates that Lamivudine sulfoxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Lamivudine sulfoxide. Following Lipinski's Rule of Five, Lamivudine sulfoxide 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 Lamivudine sulfoxide?
The CAS number of Lamivudine sulfoxide is 131086-23-2.
What is the molecular formula of Lamivudine sulfoxide?
The molecular formula of Lamivudine sulfoxide is C8H11N3O4S.
What is the molecular weight of Lamivudine sulfoxide?
The molecular weight of Lamivudine sulfoxide is 245.05 g/mol.
Where can I buy Lamivudine sulfoxide?
You can request a quote for Lamivudine sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lamivudine sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for Lamivudine sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.