Atevirdine Mesylate
TL;DR: Atevirdine Mesylate (CAS 138540-32-6) is a chemical compound with molecular formula C22H29N5O5S and molecular weight 475.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(5-methoxy-1H-indol-2-yl)methanone;methanesulfonic acid
Also Known As: Atevirdine mesylate, Atevirdine, Atevirdine mesilate, Atevirdine mesylate [USAN], ATEVIRDINE SULPHATE
| Molecular Formula | C22H29N5O5S |
|---|---|
| Molecular Weight | 475.19 g/mol |
| LogP | 2.47 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.18893 |
| Heavy Atoms | 33 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 138540-32-6 |
|---|---|
| SMILES | CCNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)OC.CS(=O)(=O)O |
| InChIKey | HKPKBPALSLUFFM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Atevirdine Mesylate (CAS 138540-32-6), with molecular formula C22H29N5O5S and molecular weight 475.19 g/mol. IUPAC: [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(5-methoxy-1H-indol-2-yl)methanone;methanesulfonic acid.
Chemical Property Profile of Atevirdine Mesylate
Property Insights of Atevirdine Mesylate
The XLogP value of 2.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Atevirdine Mesylate. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Atevirdine Mesylate. Following Lipinski's Rule of Five, Atevirdine Mesylate has 3 hydrogen bond donor(s) and 8 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 Atevirdine Mesylate?
The CAS number of Atevirdine Mesylate is 138540-32-6.
What is the molecular formula of Atevirdine Mesylate?
The molecular formula of Atevirdine Mesylate is C22H29N5O5S.
What is the molecular weight of Atevirdine Mesylate?
The molecular weight of Atevirdine Mesylate is 475.19 g/mol.
Where can I buy Atevirdine Mesylate?
You can request a quote for Atevirdine Mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Atevirdine Mesylate?
Yes, KEHONG BIO provides custom synthesis services for Atevirdine Mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.