8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine
TL;DR: 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine (CAS 375357-12-3) is a chemical compound with molecular formula C18H13BrN2O3 and molecular weight 384.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine
Also Known As: VU0060906-1, 8-bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine, 8-bromo-2-(4-nitrophenyl)-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine, 8-BROMO-2-(4-NITROPHENYL)-1H,2H,3H-NAPHTHO[1,2-E][1,3]OXAZINE
| Molecular Formula | C18H13BrN2O3 |
|---|---|
| Molecular Weight | 384.01 g/mol |
| LogP | 4.867 |
| Topological Polar Surface Area | 55.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 384.01096 |
| Heavy Atoms | 24 |
| Complexity | 940.8968 |
Chemical Identifiers
| CAS Number | 375357-12-3 |
|---|---|
| SMILES | C1C2=C(C=CC3=C2C=CC(=C3)Br)OCN1C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine (CAS 375357-12-3), with molecular formula C18H13BrN2O3 and molecular weight 384.01 g/mol. IUPAC: 8-bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine.
Chemical Property Profile of 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine
Property Insights of 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine
The XLogP value of 4.867 indicates that 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.61 Ų, 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine has 0 hydrogen bond donor(s) and 4 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-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine?
The CAS number of 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine is 375357-12-3.
What is the molecular formula of 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine?
The molecular formula of 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine is C18H13BrN2O3.
What is the molecular weight of 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine?
The molecular weight of 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine is 384.01 g/mol.
Where can I buy 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine?
You can request a quote for 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][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 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 8-Bromo-2-(4-nitrophenyl)-1,3-dihydrobenzo[f][1,3]benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.