6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine
TL;DR: 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine (CAS 7331-80-8) is a chemical compound with molecular formula C14H11Br2NO and molecular weight 366.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-(4-bromophenyl)-2,4-dihydro-1,3-benzoxazine
Also Known As: 6-bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine, 6-bromo-3-(4-bromophenyl)-2,4-dihydro-1,3-benzoxazine, 3,4-Dihydro-3-(4-bromophenyl)-6-bromo-2H-1,3-benzoxazine, 6-BROMO-3- -3,4-DIHYDRO-2H-BENZO[E][1,3]OXAZINE, 6-bromo-3-(4-bromophenyl)-3,4-dihydro-2H-benzo[e][1,3]oxazine
| Molecular Formula | C14H11Br2NO |
|---|---|
| Molecular Weight | 366.92 g/mol |
| LogP | 4.5681 |
| Topological Polar Surface Area | 12.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 366.92075 |
| Heavy Atoms | 18 |
| Complexity | 568.5067 |
Chemical Identifiers
| CAS Number | 7331-80-8 |
|---|---|
| SMILES | C1C2=C(C=CC(=C2)Br)OCN1C3=CC=C(C=C3)Br |
Product Overview
6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine (CAS 7331-80-8), with molecular formula C14H11Br2NO and molecular weight 366.92 g/mol. IUPAC: 6-bromo-3-(4-bromophenyl)-2,4-dihydro-1,3-benzoxazine.
Chemical Property Profile of 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine
Property Insights of 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine
The XLogP value of 4.5681 indicates that 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.47 Ų, 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine has 0 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-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine?
The CAS number of 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine is 7331-80-8.
What is the molecular formula of 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine?
The molecular formula of 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine is C14H11Br2NO.
What is the molecular weight of 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine?
The molecular weight of 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine is 366.92 g/mol.
Where can I buy 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine?
You can request a quote for 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-3-(4-bromophenyl)-3,4-dihydro-2H-1,3-benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.