Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-
TL;DR: Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- (CAS 11005-21-3) is a chemical compound with molecular formula C14H9BrClNO and molecular weight 320.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)methyl]-5-chloro-1,3-benzoxazole
Also Known As: 2-[(4-bromophenyl)methyl]-5-chloro-1,3-benzoxazole, 2-(4-bromobenzyl)-5-chloro-1,3-benzoxazole, 2-(4-Bromobenzyl)-5-chlorobenzoxazole, 5-Chloro-2-(4-bromobenzyl)benzoxazole, Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-
| Molecular Formula | C14H9BrClNO |
|---|---|
| Molecular Weight | 320.96 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.9556 |
| Heavy Atoms | 18 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 11005-21-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=NC3=C(O2)C=CC(=C3)Cl)Br |
| InChIKey | UUCVQIQOMQYYQD-UHFFFAOYSA-N |
Product Overview
Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- (CAS 11005-21-3), with molecular formula C14H9BrClNO and molecular weight 320.96 g/mol. IUPAC: 2-[(4-bromophenyl)methyl]-5-chloro-1,3-benzoxazole.
Chemical Property Profile of Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-
Property Insights of Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-
The XLogP value of 5.0 indicates that Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- 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 Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-?
The CAS number of Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- is 11005-21-3.
What is the molecular formula of Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-?
The molecular formula of Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- is C14H9BrClNO.
What is the molecular weight of Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-?
The molecular weight of Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- is 320.96 g/mol.
Where can I buy Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-?
You can request a quote for Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Benzoxazole, 2-((4-bromophenyl)methyl)-5-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.