6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine
TL;DR: 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine (CAS 385405-46-9) is a chemical compound with molecular formula C20H15BrN2O3 and molecular weight 410.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-(4-nitrophenyl)-4-phenyl-2,4-dihydro-1H-3,1-benzoxazine
Also Known As: ChemDiv1_021386, 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine, 6-bromo-2-(4-nitrophenyl)-4-phenyl-2,4-dihydro-1H-3,1-benzoxazine, AF-399/15284019, 6-bromo-2-(4-nitrophenyl)-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine
| Molecular Formula | C20H15BrN2O3 |
|---|---|
| Molecular Weight | 410.03 g/mol |
| LogP | 5.5876 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.0266 |
| Heavy Atoms | 26 |
| Complexity | 945.0299 |
Chemical Identifiers
| CAS Number | 385405-46-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C3=C(C=CC(=C3)Br)NC(O2)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine (CAS 385405-46-9), with molecular formula C20H15BrN2O3 and molecular weight 410.03 g/mol. IUPAC: 6-bromo-2-(4-nitrophenyl)-4-phenyl-2,4-dihydro-1H-3,1-benzoxazine.
Chemical Property Profile of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine
Property Insights of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine
The XLogP value of 5.5876 indicates that 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine. Following Lipinski's Rule of Five, 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine?
The CAS number of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine is 385405-46-9.
What is the molecular formula of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine?
The molecular formula of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine is C20H15BrN2O3.
What is the molecular weight of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine?
The molecular weight of 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine is 410.03 g/mol.
Where can I buy 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine?
You can request a quote for 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-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-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-2-{4-nitrophenyl}-4-phenyl-1,4-dihydro-2H-3,1-benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.