Emtricitabine mixture with tenofovir disoproxil fumarate
TL;DR: Emtricitabine mixture with tenofovir disoproxil fumarate (CAS 731772-45-5) is a chemical compound with molecular formula C31H44FN8O17PS and molecular weight 882.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one;[[(2S)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;(E)-but-2-enedioic acid
Also Known As: Emtricitabine mixture with tenofovir disoproxil fumarate
| Molecular Formula | C31H44FN8O17PS |
|---|---|
| Molecular Weight | 882.23 g/mol |
| LogP | 2.2924 |
| Topological Polar Surface Area | 350.41 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 17 |
| Exact Mass | 882.2267 |
| Heavy Atoms | 59 |
| Complexity | 1954.1146 |
Chemical Identifiers
| CAS Number | 731772-45-5 |
|---|---|
| SMILES | C[C@@H](CN1C=NC2=C(N=CN=C21)N)OCP(=O)(OCOC(=O)OC(C)C)OCOC(=O)OC(C)C.C1[C@H](O[C@H](S1)CO)N2C=C(C(=NC2=O)N)F.C(=C/C(=O)O)\C(=O)O |
Product Overview
Emtricitabine mixture with tenofovir disoproxil fumarate (CAS 731772-45-5), with molecular formula C31H44FN8O17PS and molecular weight 882.23 g/mol. IUPAC: 4-amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one;[[(2S)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;(E)-but-2-enedioic acid.
Chemical Property Profile of Emtricitabine mixture with tenofovir disoproxil fumarate
Property Insights of Emtricitabine mixture with tenofovir disoproxil fumarate
The XLogP value of 2.2924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Emtricitabine mixture with tenofovir disoproxil fumarate. The TPSA of 350.41 Ų indicates high polarity, suggesting Emtricitabine mixture with tenofovir disoproxil fumarate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Emtricitabine mixture with tenofovir disoproxil fumarate has 5 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Emtricitabine mixture with tenofovir disoproxil fumarate?
The CAS number of Emtricitabine mixture with tenofovir disoproxil fumarate is 731772-45-5.
What is the molecular formula of Emtricitabine mixture with tenofovir disoproxil fumarate?
The molecular formula of Emtricitabine mixture with tenofovir disoproxil fumarate is C31H44FN8O17PS.
What is the molecular weight of Emtricitabine mixture with tenofovir disoproxil fumarate?
The molecular weight of Emtricitabine mixture with tenofovir disoproxil fumarate is 882.23 g/mol.
Where can I buy Emtricitabine mixture with tenofovir disoproxil fumarate?
You can request a quote for Emtricitabine mixture with tenofovir disoproxil fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Emtricitabine mixture with tenofovir disoproxil fumarate?
Yes, KEHONG BIO provides custom synthesis services for Emtricitabine mixture with tenofovir disoproxil fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.