2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole
TL;DR: 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole (CAS 61712-41-2) is a chemical compound with molecular formula C13H7BrClNO and molecular weight 306.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromophenyl)-5-chloro-1,3-benzoxazole
Also Known As: 2-(3-bromophenyl)-5-chloro-1,3-benzoxazole, Benzoxazole, 2-(3-bromophenyl)-5-chloro-, 2-(3-bromo-phenyl)-5-chloro-benzooxazole
| Molecular Formula | C13H7BrClNO |
|---|---|
| Molecular Weight | 306.94 g/mol |
| LogP | 4.9107 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.93994 |
| Heavy Atoms | 17 |
| Complexity | 692.7023 |
Chemical Identifiers
| CAS Number | 61712-41-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C2=NC3=C(O2)C=CC(=C3)Cl |
Product Overview
2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole (CAS 61712-41-2), with molecular formula C13H7BrClNO and molecular weight 306.94 g/mol. IUPAC: 2-(3-bromophenyl)-5-chloro-1,3-benzoxazole.
Chemical Property Profile of 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole
Property Insights of 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole
The XLogP value of 4.9107 indicates that 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.03 Ų, 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole 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 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole?
The CAS number of 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole is 61712-41-2.
What is the molecular formula of 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole?
The molecular formula of 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole is C13H7BrClNO.
What is the molecular weight of 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole?
The molecular weight of 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole is 306.94 g/mol.
Where can I buy 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole?
You can request a quote for 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Bromophenyl)-5-chloro-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.