![2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid structure](/static/products/874/874590-50-8.png)
2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid
TL;DR: 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid (CAS 874590-50-8) is a chemical compound with molecular formula C17H13ClN2O5 and molecular weight 360.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]benzoic acid
Also Known As: BAS 12919722, 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid, 2-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]benzoic acid, 2-{[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetyl]amino}benzoic acid
| Molecular Formula | C17H13ClN2O5 |
|---|---|
| Molecular Weight | 360.05 g/mol |
| LogP | 2.4023 |
| Topological Polar Surface Area | 95.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.0513 |
| Heavy Atoms | 25 |
| Complexity | 867.86676 |
Chemical Identifiers
| CAS Number | 874590-50-8 |
|---|---|
| SMILES | C1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CC(=O)NC3=CC=CC=C3C(=O)O |
Product Overview
2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid (CAS 874590-50-8), with molecular formula C17H13ClN2O5 and molecular weight 360.05 g/mol. IUPAC: 2-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]benzoic acid.
Chemical Property Profile of 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid
Property Insights of 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid
The XLogP value of 2.4023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid. The TPSA of 95.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid. Following Lipinski's Rule of Five, 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)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 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid?
The CAS number of 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid is 874590-50-8.
What is the molecular formula of 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid?
The molecular formula of 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid is C17H13ClN2O5.
What is the molecular weight of 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid?
The molecular weight of 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid is 360.05 g/mol.
Where can I buy 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid?
You can request a quote for 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(6-chloro-3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.