6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one
TL;DR: 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one (CAS 24036-49-5) is a chemical compound with molecular formula C8H5Br2NO2 and molecular weight 304.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dibromo-4H-1,4-benzoxazin-3-one
Also Known As: 6,7-dibromo-4H-1,4-benzoxazin-3-one, 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one, 6,7-dibromo-2H-benzo[b][1,4]oxazin-3(4H)-one, 2,6-Dichloro-benzenesulfonic acid, SALOR-INT L168203-1EA
| Molecular Formula | C8H5Br2NO2 |
|---|---|
| Molecular Weight | 304.87 g/mol |
| LogP | 2.5425 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.8687 |
| Heavy Atoms | 13 |
| Complexity | 378.65192 |
Chemical Identifiers
| CAS Number | 24036-49-5 |
|---|---|
| SMILES | C1C(=O)NC2=CC(=C(C=C2O1)Br)Br |
Product Overview
6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one (CAS 24036-49-5), with molecular formula C8H5Br2NO2 and molecular weight 304.87 g/mol. IUPAC: 6,7-dibromo-4H-1,4-benzoxazin-3-one.
Chemical Property Profile of 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one
Property Insights of 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one
The XLogP value of 2.5425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one. With a topological polar surface area (TPSA) of 38.33 Ų, 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one has 1 hydrogen bond donor(s) and 2 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 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one?
The CAS number of 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one is 24036-49-5.
What is the molecular formula of 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one?
The molecular formula of 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one is C8H5Br2NO2.
What is the molecular weight of 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one?
The molecular weight of 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one is 304.87 g/mol.
Where can I buy 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one?
You can request a quote for 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dibromo-2H-1,4-benzoxazin-3(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.