Jpb 52
TL;DR: Jpb 52 (CAS 76752-01-7) is a chemical compound with molecular formula C17H13NO5 and molecular weight 311.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Jpb 52
3-(6-benzoyl-2-oxo-1,3-benzoxazol-3-yl)propanoic acid
Also Known As: 6-Benzoyl-2-oxo-3-benzoxazolinepropionic acid, 3-BENZOXAZOLINEPROPIONIC ACID, 6-BENZOYL-2-OXO-, 3(2H)-Benzoxazolepropanoicacid, 6-benzoyl-2-oxo-, 3-(6-benzoyl-2-oxo-1,3-benzoxazol-3-yl)propanoic acid, 6-Benzoyl-2-oxo-3(2H)-benzoxazolepropionic acid
| Molecular Formula | C17H13NO5 |
|---|---|
| Molecular Weight | 311.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.07938 |
| Heavy Atoms | 23 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 76752-01-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)O |
| InChIKey | HHGQHMARMJYJMK-UHFFFAOYSA-N |
Product Overview
Jpb 52 (CAS 76752-01-7), with molecular formula C17H13NO5 and molecular weight 311.08 g/mol. IUPAC: 3-(6-benzoyl-2-oxo-1,3-benzoxazol-3-yl)propanoic acid.
Chemical Property Profile of Jpb 52
Property Insights of Jpb 52
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Jpb 52. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Jpb 52. Following Lipinski's Rule of Five, Jpb 52 has 1 hydrogen bond donor(s) and 5 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 Jpb 52?
The CAS number of Jpb 52 is 76752-01-7.
What is the molecular formula of Jpb 52?
The molecular formula of Jpb 52 is C17H13NO5.
What is the molecular weight of Jpb 52?
The molecular weight of Jpb 52 is 311.08 g/mol.
Where can I buy Jpb 52?
You can request a quote for Jpb 52 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Jpb 52?
Yes, KEHONG BIO provides custom synthesis services for Jpb 52 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.