Tropesin
TL;DR: Tropesin (CAS 65189-78-8) is a chemical compound with molecular formula C28H24ClNO6 and molecular weight 505.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxy-2-phenylpropanoic acid
Also Known As: Tropesin, Repanidal, Tropesin (+-)-, Tropesin (unspecified), Vufb 12018
| Molecular Formula | C28H24ClNO6 |
|---|---|
| Molecular Weight | 505.13 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 505.1292 |
| Heavy Atoms | 36 |
| Complexity | 778.0 |
Chemical Identifiers
| CAS Number | 65189-78-8 |
|---|---|
| SMILES | CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC(C4=CC=CC=C4)C(=O)O |
| InChIKey | UCCJWNPWWPJKGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tropesin (CAS 65189-78-8), with molecular formula C28H24ClNO6 and molecular weight 505.13 g/mol. IUPAC: 3-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxy-2-phenylpropanoic acid.
Chemical Property Profile of Tropesin
Property Insights of Tropesin
The XLogP value of 5.8 indicates that Tropesin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Tropesin. Following Lipinski's Rule of Five, Tropesin has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tropesin?
The CAS number of Tropesin is 65189-78-8.
What is the molecular formula of Tropesin?
The molecular formula of Tropesin is C28H24ClNO6.
What is the molecular weight of Tropesin?
The molecular weight of Tropesin is 505.13 g/mol.
Where can I buy Tropesin?
You can request a quote for Tropesin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tropesin?
Yes, KEHONG BIO provides custom synthesis services for Tropesin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.