6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione
TL;DR: 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione (CAS 522625-95-2) is a chemical compound with molecular formula C16H11Br2NO3 and molecular weight 422.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dibromo-3-(2-ethylphenyl)-1,3-benzoxazine-2,4-dione
Also Known As: 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione, 6,8-dibromo-3-(2-ethylphenyl)-1,3-benzoxazine-2,4-dione, 6,8-dibromo-3-(2-ethylphenyl)benzo[e]1,3-oxazaperhydroine-2,4-dione, 3,5-dibromo-9-(2-ethylphenyl)-7-oxa-9-azabicyclo[4.4.0]deca-2,4,11-triene-8,10-dione
| Molecular Formula | C16H11Br2NO3 |
|---|---|
| Molecular Weight | 422.91 g/mol |
| LogP | 4.0313 |
| Topological Polar Surface Area | 52.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 422.91058 |
| Heavy Atoms | 22 |
| Complexity | 988.82794 |
Chemical Identifiers
| CAS Number | 522625-95-2 |
|---|---|
| SMILES | CCC1=CC=CC=C1N2C(=O)C3=C(C(=CC(=C3)Br)Br)OC2=O |
Product Overview
6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione (CAS 522625-95-2), with molecular formula C16H11Br2NO3 and molecular weight 422.91 g/mol. IUPAC: 6,8-dibromo-3-(2-ethylphenyl)-1,3-benzoxazine-2,4-dione.
Chemical Property Profile of 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione
Property Insights of 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione
The XLogP value of 4.0313 indicates that 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.21 Ų, 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione has 0 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 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione?
The CAS number of 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione is 522625-95-2.
What is the molecular formula of 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione?
The molecular formula of 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione is C16H11Br2NO3.
What is the molecular weight of 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione?
The molecular weight of 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione is 422.91 g/mol.
Where can I buy 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione?
You can request a quote for 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6,8-dibromo-3-(2-ethylphenyl)-2H-1,3-benzoxazine-2,4(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.