![2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid structure](/static/products/983/98358-90-8.png)
2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid
TL;DR: 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid (CAS 98358-90-8) is a chemical compound with molecular formula C20H13NO5 and molecular weight 347.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,9-dihydroxybenzo[b][1,4]benzoxazepin-6-yl)benzoic acid
Also Known As: 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid, 2-(3,7-Dihydroxydibenzo[b,f][1,4]oxazepin-11-yl)benzoic acid, BAS 00851558, 2-(2,9-dihydroxybenzo[b][1,4]benzoxazepin-6-yl)benzoic acid, BRD-K43485909-001-10-8
| Molecular Formula | C20H13NO5 |
|---|---|
| Molecular Weight | 347.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.07938 |
| Heavy Atoms | 26 |
| Complexity | 564.0 |
Chemical Identifiers
| CAS Number | 98358-90-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NC3=C(C=C(C=C3)O)OC4=C2C=CC(=C4)O)C(=O)O |
| InChIKey | FOPDVSATCFBKCH-UHFFFAOYSA-N |
Product Overview
2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid (CAS 98358-90-8), with molecular formula C20H13NO5 and molecular weight 347.08 g/mol. IUPAC: 2-(2,9-dihydroxybenzo[b][1,4]benzoxazepin-6-yl)benzoic acid.
Chemical Property Profile of 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid
Property Insights of 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid
The XLogP value of 3.4 indicates that 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid. Following Lipinski's Rule of Five, 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid has 3 hydrogen bond donor(s) and 6 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-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid?
The CAS number of 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid is 98358-90-8.
What is the molecular formula of 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid?
The molecular formula of 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid is C20H13NO5.
What is the molecular weight of 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid?
The molecular weight of 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid is 347.08 g/mol.
Where can I buy 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid?
You can request a quote for 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-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-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,7-Dihydroxy-dibenzo[b,f][1,4]oxazepin-11-yl)-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.