![3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid structure](/static/products/5768/5768-08-1.webp)
3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid
TL;DR: 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid (CAS 5768-08-1) is a chemical compound with molecular formula C18H18BrNO4 and molecular weight 391.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic acid
Also Known As: 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid, 3-[(3-bromophenyl)carbonylamino]-3-(4-ethoxyphenyl)propanoic acid, 3-(3-Bromobenzamido)-3-(4-ethoxyphenyl)propanoic acid
| Molecular Formula | C18H18BrNO4 |
|---|---|
| Molecular Weight | 391.04 g/mol |
| LogP | 3.7936 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.04193 |
| Heavy Atoms | 24 |
| Complexity | 715.2136 |
Chemical Identifiers
| CAS Number | 5768-08-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CC=C2)Br |
Product Overview
3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid (CAS 5768-08-1), with molecular formula C18H18BrNO4 and molecular weight 391.04 g/mol. IUPAC: 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic acid.
Chemical Property Profile of 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid
Property Insights of 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid
The XLogP value of 3.7936 indicates that 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid. Following Lipinski's Rule of Five, 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)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-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid?
The CAS number of 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid is 5768-08-1.
What is the molecular formula of 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid?
The molecular formula of 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid is C18H18BrNO4.
What is the molecular weight of 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid?
The molecular weight of 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid is 391.04 g/mol.
Where can I buy 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid?
You can request a quote for 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)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-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-bromobenzoyl)amino]-3-(4-ethoxyphenyl)propanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.