4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid
TL;DR: 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid (CAS 484048-78-4) is a chemical compound with molecular formula C17H18N2O5 and molecular weight 330.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid
Also Known As: F1278-0410, 4-(4-acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid, 2-(furfurylamino)-3-(N-p-acetylphenylcarbamoyl)propionic acid, 3-[(4-acetylphenyl)carbamoyl]-2-{[(furan-2-yl)methyl]amino}propanoic acid, 4-((4-acetylphenyl)amino)-2-((furan-2-ylmethyl)amino)-4-oxobutanoic acid
| Molecular Formula | C17H18N2O5 |
|---|---|
| Molecular Weight | 330.12 g/mol |
| LogP | 2.0538 |
| Topological Polar Surface Area | 108.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 330.12158 |
| Heavy Atoms | 24 |
| Complexity | 707.0919 |
Chemical Identifiers
| CAS Number | 484048-78-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCC2=CC=CO2 |
Product Overview
4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid (CAS 484048-78-4), with molecular formula C17H18N2O5 and molecular weight 330.12 g/mol. IUPAC: 4-(4-acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid.
Chemical Property Profile of 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid
Property Insights of 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid
The XLogP value of 2.0538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid. The TPSA of 108.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid has 3 hydrogen bond donor(s) and 5 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-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid?
The CAS number of 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid is 484048-78-4.
What is the molecular formula of 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid?
The molecular formula of 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid is C17H18N2O5.
What is the molecular weight of 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid?
The molecular weight of 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid is 330.12 g/mol.
Where can I buy 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid?
You can request a quote for 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic 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-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Acetylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.