3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine
TL;DR: 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine (CAS 35183-57-4) is a chemical compound with molecular formula C14H11BrClNO and molecular weight 322.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)-6-chloro-2,4-dihydro-1,3-benzoxazine
Also Known As: 3-6-chloro-3,4-dihydro-2h-benzo[e][1,3]oxazine, 3-(4-bromophenyl)-6-chloro-2,4-dihydro-1,3-benzoxazine, 3- -6-CHLORO-3,4-DIHYDRO-2H-BENZO[E][1,3]OXAZINE, 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine, 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-benzo[e][1,3]oxazine
| Molecular Formula | C14H11BrClNO |
|---|---|
| Molecular Weight | 322.97 g/mol |
| LogP | 4.459 |
| Topological Polar Surface Area | 12.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 322.97125 |
| Heavy Atoms | 18 |
| Complexity | 570.5067 |
Chemical Identifiers
| CAS Number | 35183-57-4 |
|---|---|
| SMILES | C1C2=C(C=CC(=C2)Cl)OCN1C3=CC=C(C=C3)Br |
Product Overview
3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine (CAS 35183-57-4), with molecular formula C14H11BrClNO and molecular weight 322.97 g/mol. IUPAC: 3-(4-bromophenyl)-6-chloro-2,4-dihydro-1,3-benzoxazine.
Chemical Property Profile of 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine
Property Insights of 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine
The XLogP value of 4.459 indicates that 3-(4-bromophenyl)-6-chloro-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, 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-bromophenyl)-6-chloro-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 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine?
The CAS number of 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine is 35183-57-4.
What is the molecular formula of 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine?
The molecular formula of 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine is C14H11BrClNO.
What is the molecular weight of 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine?
The molecular weight of 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine is 322.97 g/mol.
Where can I buy 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine?
You can request a quote for 3-(4-bromophenyl)-6-chloro-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 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-bromophenyl)-6-chloro-3,4-dihydro-2H-1,3-benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.