![4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid structure](/static/products/2195/219544-55-5.webp)
4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid
TL;DR: 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid (CAS 219544-55-5) is a chemical compound with molecular formula C19H18ClNO2 and molecular weight 327.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-[(4-chlorophenyl)methyl]indol-3-yl]butanoic acid
Also Known As: 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid, 4-[1-[(4-chlorophenyl)methyl]indol-3-yl]butanoic Acid, 4-{1-[(4-chlorophenyl)methyl]-1H-indol-3-yl}butanoic acid, 8W-0852, 4-{1-[(4-chlorophenyl)methyl]indol-3-yl}butanoic acid
| Molecular Formula | C19H18ClNO2 |
|---|---|
| Molecular Weight | 327.10 g/mol |
| LogP | 4.7503 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.1026 |
| Heavy Atoms | 23 |
| Complexity | 821.00684 |
Chemical Identifiers
| CAS Number | 219544-55-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Cl)CCCC(=O)O |
Product Overview
4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid (CAS 219544-55-5), with molecular formula C19H18ClNO2 and molecular weight 327.10 g/mol. IUPAC: 4-[1-[(4-chlorophenyl)methyl]indol-3-yl]butanoic acid.
Chemical Property Profile of 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid
Property Insights of 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid
The XLogP value of 4.7503 indicates that 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.23 Ų, 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid has 1 hydrogen bond donor(s) and 1 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 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid?
The CAS number of 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid is 219544-55-5.
What is the molecular formula of 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid?
The molecular formula of 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid is C19H18ClNO2.
What is the molecular weight of 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid?
The molecular weight of 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid is 327.10 g/mol.
Where can I buy 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid?
You can request a quote for 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[1-(4-chlorobenzyl)-1H-indol-3-yl]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.