2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester
TL;DR: 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester (CAS 61295-40-7) is a chemical compound with molecular formula C23H26Cl2N2O2 and molecular weight 432.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-chloro-3-(4-chlorophenyl)-2-[2-(diethylamino)ethyl]isoindole-1-carboxylate
Also Known As: 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester, 5-Chloro-3-(p-chlorophenyl)-2-(2-(diethylamino)ethyl)isoindole-1-carboxylic acid ethyl ester, ethyl 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylate, Ethyl 5-chloro-3-(4-chlorophenyl)-2-[2-(diethylamino)ethyl]-2H-isoindole-1-carboxylate, RefChem:268743
| Molecular Formula | C23H26Cl2N2O2 |
|---|---|
| Molecular Weight | 432.14 g/mol |
| LogP | 6.1336 |
| Topological Polar Surface Area | 34.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 432.13715 |
| Heavy Atoms | 29 |
| Complexity | 992.27563 |
Chemical Identifiers
| CAS Number | 61295-40-7 |
|---|---|
| SMILES | CCN(CC)CCN1C(=C2C=C(C=CC2=C1C(=O)OCC)Cl)C3=CC=C(C=C3)Cl |
Product Overview
2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester (CAS 61295-40-7), with molecular formula C23H26Cl2N2O2 and molecular weight 432.14 g/mol. IUPAC: ethyl 5-chloro-3-(4-chlorophenyl)-2-[2-(diethylamino)ethyl]isoindole-1-carboxylate.
Chemical Property Profile of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester
Property Insights of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester
The XLogP value of 6.1336 indicates that 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.47 Ų, 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester?
The CAS number of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester is 61295-40-7.
What is the molecular formula of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester?
The molecular formula of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester is C23H26Cl2N2O2.
What is the molecular weight of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester?
The molecular weight of 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester is 432.14 g/mol.
Where can I buy 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester?
You can request a quote for 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2H-Isoindole-1-carboxylic acid, 5-chloro-3-(4-chlorophenyl)-2-(2-(diethylamino)ethyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.