![4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid structure](/static/products/3092/309272-89-7.webp)
4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid
TL;DR: 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid (CAS 309272-89-7) is a chemical compound with molecular formula C17H13ClN2O4 and molecular weight 344.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid
Also Known As: AB00119134-01, 4-[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid, 4-((4-(5-chlorobenzo[d]oxazol-2-yl)phenyl)amino)-4-oxobutanoic acid, 4-{[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]amino}-4-oxobutanoic acid, 3-[[4-(5-chlorobenzooxazol-2-yl)phenyl]carbamoyl]propanoic Acid
| Molecular Formula | C17H13ClN2O4 |
|---|---|
| Molecular Weight | 344.06 g/mol |
| LogP | 3.9515 |
| Topological Polar Surface Area | 92.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.0564 |
| Heavy Atoms | 24 |
| Complexity | 902.5995 |
Chemical Identifiers
| CAS Number | 309272-89-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)CCC(=O)O |
Product Overview
4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid (CAS 309272-89-7), with molecular formula C17H13ClN2O4 and molecular weight 344.06 g/mol. IUPAC: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid.
Chemical Property Profile of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid
Property Insights of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid
The XLogP value of 3.9515 indicates that 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic 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
Frequently Asked Questions
What is the CAS number of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid?
The CAS number of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid is 309272-89-7.
What is the molecular formula of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid?
The molecular formula of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid is C17H13ClN2O4.
What is the molecular weight of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid?
The molecular weight of 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid is 344.06 g/mol.
Where can I buy 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid?
You can request a quote for 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-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-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(5-Chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.