8-amino-5H-benzo[b][1,4]benzoxazepin-6-one
TL;DR: 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one (CAS 23474-66-0) is a chemical compound with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-amino-5H-benzo[b][1,4]benzoxazepin-6-one
Also Known As: 2-aminodibenzo[b,f][1,4]oxazepin-11(10H)-one, 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one, 2-Amino-10H-dibenzo[b,f][1,4]oxazepin-11-one, BAS 00321212, 2-amino-10H-dibenzo[b,f]1,4-oxazepin-11-one
| Molecular Formula | C13H10N2O2 |
|---|---|
| Molecular Weight | 226.07 g/mol |
| LogP | 2.6268 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.07423 |
| Heavy Atoms | 17 |
| Complexity | 608.11847 |
Chemical Identifiers
| CAS Number | 23474-66-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=O)C3=C(O2)C=CC(=C3)N |
Product Overview
8-amino-5H-benzo[b][1,4]benzoxazepin-6-one (CAS 23474-66-0), with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol. IUPAC: 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one.
Chemical Property Profile of 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one
Property Insights of 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one
The XLogP value of 2.6268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one. Following Lipinski's Rule of Five, 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one has 2 hydrogen bond donor(s) and 3 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 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one?
The CAS number of 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one is 23474-66-0.
What is the molecular formula of 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one?
The molecular formula of 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one is C13H10N2O2.
What is the molecular weight of 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one?
The molecular weight of 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one is 226.07 g/mol.
Where can I buy 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one?
You can request a quote for 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 8-amino-5H-benzo[b][1,4]benzoxazepin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.