3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid
TL;DR: 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid (CAS 144989-41-3) is a chemical compound with molecular formula C14H13Cl2NO4 and molecular weight 329.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4,6-dichloro-2-ethoxycarbonyl-1H-indol-3-yl)propanoic acid
Also Known As: Maybridge1_008008, 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid, 3-(4,6-dichloro-2-ethoxycarbonyl-1H-indol-3-yl)propanoic acid, 4,6-Dichloro-2-(ethoxycarbonyl)-1H-Indole-3-propanoic Acid, J2.013.275B
| Molecular Formula | C14H13Cl2NO4 |
|---|---|
| Molecular Weight | 329.02 g/mol |
| LogP | 3.6686 |
| Topological Polar Surface Area | 79.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.02216 |
| Heavy Atoms | 21 |
| Complexity | 708.5522 |
Chemical Identifiers
| CAS Number | 144989-41-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=C(C=C2Cl)Cl)CCC(=O)O |
Product Overview
3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid (CAS 144989-41-3), with molecular formula C14H13Cl2NO4 and molecular weight 329.02 g/mol. IUPAC: 3-(4,6-dichloro-2-ethoxycarbonyl-1H-indol-3-yl)propanoic acid.
Chemical Property Profile of 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid
Property Insights of 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid
The XLogP value of 3.6686 indicates that 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid has 2 hydrogen bond donor(s) and 3 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 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid?
The CAS number of 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid is 144989-41-3.
What is the molecular formula of 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid?
The molecular formula of 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid is C14H13Cl2NO4.
What is the molecular weight of 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid?
The molecular weight of 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid is 329.02 g/mol.
Where can I buy 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid?
You can request a quote for 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4,6-dichloro-2-(ethoxycarbonyl)-1H-indol-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.