4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid
TL;DR: 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid (CAS 1025725-26-1) is a chemical compound with molecular formula C19H21ClN2O4 and molecular weight 376.119 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(5-chloro-2-methoxyanilino)-4-oxo-2-(2-phenylethylamino)butanoic acid
Also Known As: IFLab1_005589, IDI1_010992, F1278-0774, 4-((5-chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid, 3-[(5-CHLORO-2-METHOXYPHENYL)CARBAMOYL]-2-[(2-PHENYLETHYL)AMINO]PROPANOIC ACID
Technical Specifications
| Molecular Formula | C19H21ClN2O4 |
| Molecular Weight | 376.119 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 376.119 Da |
| Heavy Atoms | 26 |
| Complexity | 457.0 |
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=O)CC(C(=O)O)NCCC2=CC=CC=C2 |
| InChIKey | JERVTSJTZVUUBF-UHFFFAOYSA-N |
Chemical Property Profile of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid
Property Insights of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid. Following Lipinski's Rule of Five, 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic 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
What is the CAS number of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid?
The CAS number of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid is 1025725-26-1.
What is the molecular formula of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid?
The molecular formula of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid is C19H21ClN2O4.
What is the molecular weight of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid?
The molecular weight of 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid is 376.119 g/mol.
Where can I buy 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid?
You can request a quote for 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-((5-Chloro-2-methoxyphenyl)amino)-4-oxo-2-(phenethylamino)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.