![4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid structure](/static/products/1025/1025762-87-1.webp)
4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid
TL;DR: 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid (CAS 1025762-87-1) is a chemical compound with molecular formula C15H14ClNO3S and molecular weight 323.0383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-chlorophenyl)-4-oxo-2-(thiophen-2-ylmethylamino)butanoic acid
Also Known As: 4-(4-chlorophenyl)-4-oxo-2-(thiophen-2-ylmethylamino)butanoic Acid, 4-(4-chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid, 4-(4-chlorophenyl)-4-oxo-2-{[(thiophen-2-yl)methyl]amino}butanoic acid, 4-(4-chlorophenyl)-4-oxo-2-[(thiophen-2-ylmethyl)amino]butanoic acid, 4-(4-chlorophenyl)-4-oxo-2-{[(thiophen-2-yl)methyl]amino}butanoicacid
Technical Specifications
| Molecular Formula | C15H14ClNO3S |
| Molecular Weight | 323.0383 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 323.0383 Da |
| Heavy Atoms | 21 |
| Complexity | 372.0 |
| SMILES | C1=CSC(=C1)CNC(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O |
| InChIKey | OJEQASZBWFPBMY-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid
Property Insights of 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid has 2 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-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid?
The CAS number of 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid is 1025762-87-1.
What is the molecular formula of 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid?
The molecular formula of 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid is C15H14ClNO3S.
What is the molecular weight of 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid?
The molecular weight of 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid is 323.0383 g/mol.
Where can I buy 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid?
You can request a quote for 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(4-Chlorophenyl)-4-oxo-2-[(2-thienylmethyl)amino]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.