4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid
TL;DR: 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid (CAS 1046820-69-2) is a chemical compound with molecular formula C16H24N2O4 and molecular weight 308.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid
Also Known As: 4-(4-methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid, 4-((4-methoxyphenyl)amino)-4-oxo-2-(pentylamino)butanoic acid, F1124-0042, 3-[(4-METHOXYPHENYL)CARBAMOYL]-2-(PENTYLAMINO)PROPANOIC ACID, 3-[N-(4-methoxyphenyl)carbamoyl]-2-(pentylamino)propanoic acid
| Molecular Formula | C16H24N2O4 |
|---|---|
| Molecular Weight | 308.17 g/mol |
| LogP | 2.2568 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 308.1736 |
| Heavy Atoms | 22 |
| Complexity | 473.5391 |
Chemical Identifiers
| CAS Number | 1046820-69-2 |
|---|---|
| SMILES | CCCCCNC(CC(=O)NC1=CC=C(C=C1)OC)C(=O)O |
Product Overview
4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid (CAS 1046820-69-2), with molecular formula C16H24N2O4 and molecular weight 308.17 g/mol. IUPAC: 4-(4-methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid.
Chemical Property Profile of 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid
Property Insights of 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid
The XLogP value of 2.2568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid. The TPSA of 87.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid. Following Lipinski's Rule of Five, 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid has 3 hydrogen bond donor(s) and 4 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-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid?
The CAS number of 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid is 1046820-69-2.
What is the molecular formula of 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid?
The molecular formula of 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid is C16H24N2O4.
What is the molecular weight of 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid?
The molecular weight of 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid is 308.17 g/mol.
Where can I buy 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid?
You can request a quote for 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)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-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxyanilino)-4-oxo-2-(pentylamino)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.