![4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid structure](/static/products/412/41250-48-0.png)
4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid
TL;DR: 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid (CAS 41250-48-0) is a chemical compound with molecular formula C15H12N2O4 and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid
Also Known As: 4-[(2-oxobenzooxazol-3-yl)methylamino]benzoic Acid, 4-[(2-oxo-benzooxazol-3-ylmethyl)-amino]-benzoic acid, 4-[(2-oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid
| Molecular Formula | C15H12N2O4 |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 2.3623 |
| Topological Polar Surface Area | 84.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.0797 |
| Heavy Atoms | 21 |
| Complexity | 845.98615 |
Chemical Identifiers
| CAS Number | 41250-48-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C(=O)O2)CNC3=CC=C(C=C3)C(=O)O |
Product Overview
4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid (CAS 41250-48-0), with molecular formula C15H12N2O4 and molecular weight 284.08 g/mol. IUPAC: 4-[(2-oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid.
Chemical Property Profile of 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid
Property Insights of 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid
The XLogP value of 2.3623 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid. The TPSA of 84.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid. Following Lipinski's Rule of Five, 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic 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-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid?
The CAS number of 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid is 41250-48-0.
What is the molecular formula of 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid?
The molecular formula of 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid is C15H12N2O4.
What is the molecular weight of 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid?
The molecular weight of 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid is 284.08 g/mol.
Where can I buy 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid?
You can request a quote for 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-Oxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.