4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid
TL;DR: 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid (CAS 1030856-03-1) is a chemical compound with molecular formula C18H18BrNO3 and molecular weight 375.047 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic acid
Also Known As: 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid, 4-(4-bromophenyl)-4-oxo-2-[(1-phenylethyl)amino]butanoic acid, 4-(4-Bromophenyl)-4-oxo-2-((1-phenylethyl)amino)butanoic acid, 4-(4-bromophenyl)-4-oxo-2-[(1-phenylethyl)amino]butanoicacid, 4-(4-bromophenyl)-4-oxo-2-[(phenylethyl)amino]butanoic acid
Technical Specifications
| Molecular Formula | C18H18BrNO3 |
| Molecular Weight | 375.047 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 375.047 Da |
| Heavy Atoms | 23 |
| Complexity | 401.0 |
| SMILES | CC(C1=CC=CC=C1)NC(CC(=O)C2=CC=C(C=C2)Br)C(=O)O |
| InChIKey | PBAINNIDDTZARI-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid
Property Insights of 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid. Following Lipinski's Rule of Five, 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid has 2 hydrogen bond donor(s) and 4 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-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid?
The CAS number of 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid is 1030856-03-1.
What is the molecular formula of 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid?
The molecular formula of 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid is C18H18BrNO3.
What is the molecular weight of 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid?
The molecular weight of 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid is 375.047 g/mol.
Where can I buy 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid?
You can request a quote for 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid?
Yes, CoreyChem provides custom synthesis services for 4-(4-bromophenyl)-4-oxo-2-(1-phenylethylamino)butanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.