![4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid structure](/static/products/1031/1031257-29-0.webp)
4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid
TL;DR: 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid (CAS 1031257-29-0) is a chemical compound with molecular formula C13H16BrNO4 and molecular weight 329.02628 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-bromophenyl)-2-(3-hydroxypropylamino)-4-oxobutanoic acid
Also Known As: 4-(4-bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid, 4-(4-bromophenyl)-2-(3-hydroxypropylamino)-4-oxobutanoic acid, 4-(4-bromophenyl)-2-(3-hydroxypropylamino)-4-oxo-butanoic Acid, 4-(4-Bromophenyl)-2-((3-hydroxypropyl)amino)-4-oxobutanoic acid, 4-(4-bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoicacid
Technical Specifications
| Molecular Formula | C13H16BrNO4 |
| Molecular Weight | 329.02628 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 329.02628 Da |
| Heavy Atoms | 19 |
| Complexity | 303.0 |
| SMILES | C1=CC(=CC=C1C(=O)CC(C(=O)O)NCCCO)Br |
| InChIKey | ZCHPQNRKKSIOGQ-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid
Property Insights of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid
The XLogP value of -1.2 indicates that 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-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
What is the CAS number of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid?
The CAS number of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid is 1031257-29-0.
What is the molecular formula of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid?
The molecular formula of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid is C13H16BrNO4.
What is the molecular weight of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid?
The molecular weight of 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid is 329.02628 g/mol.
Where can I buy 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid?
You can request a quote for 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(4-Bromophenyl)-2-[(3-hydroxypropyl)amino]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.