CGS 7181
TL;DR: CGS 7181 (CAS 200345-93-3) is a chemical compound with molecular formula C20H17F3N2O4 and molecular weight 406.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-hydroxy-1-[(4-methylphenyl)carbamoyl]-6-(trifluoromethyl)indole-3-carboxylate
Also Known As: CGS 7181, 1H-Indole-3-carboxylic acid, 1-(((4-methylphenyl)amino)carbonyl)-2-hydroxy-6-(trifluoromethyl)-, ethyl ester, 1H-Indole-3-carboxylic acid, 2-hydroxy-1-(((4-methylphenyl)amino)carbonyl)-6-(trifluoromethyl)-, ethyl ester, ethyl 2-hydroxy-1-[(4-methylphenyl)carbamoyl]-6-(trifluoromethyl)indole-3-carboxylate, ethyl 2-hydroxy-1-[(4-methylphenyl)carbamoyl]-6-(trifluoromethyl)-1H-indole-3-carboxylate
| Molecular Formula | C20H17F3N2O4 |
|---|---|
| Molecular Weight | 406.11 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.11404 |
| Heavy Atoms | 29 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 200345-93-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC=C(C=C3)C)O |
| InChIKey | YMEXYIFTFLKKQK-UHFFFAOYSA-N |
Product Overview
CGS 7181 (CAS 200345-93-3), with molecular formula C20H17F3N2O4 and molecular weight 406.11 g/mol. IUPAC: ethyl 2-hydroxy-1-[(4-methylphenyl)carbamoyl]-6-(trifluoromethyl)indole-3-carboxylate.
Chemical Property Profile of CGS 7181
Property Insights of CGS 7181
The XLogP value of 5.3 indicates that CGS 7181 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for CGS 7181. Following Lipinski's Rule of Five, CGS 7181 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CGS 7181?
The CAS number of CGS 7181 is 200345-93-3.
What is the molecular formula of CGS 7181?
The molecular formula of CGS 7181 is C20H17F3N2O4.
What is the molecular weight of CGS 7181?
The molecular weight of CGS 7181 is 406.11 g/mol.
Where can I buy CGS 7181?
You can request a quote for CGS 7181 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CGS 7181?
Yes, KEHONG BIO provides custom synthesis services for CGS 7181 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.