![2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole structure](/static/products/3097/309732-18-1.webp)
2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole
TL;DR: 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole (CAS 309732-18-1) is a chemical compound with molecular formula C15H12BrNOS and molecular weight 332.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-bromophenyl)sulfanylethyl]-1,3-benzoxazole
Also Known As: BAS 01215430, 2-{2-[(4-bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole, Benzoxazole, 2-[2-(4-bromophenylthio)ethyl]-, 2-[2-(4-bromophenyl)sulfanylethyl]-1,3-benzoxazole, 1-(2-benzoxazol-2-ylethylthio)-4-bromobenzene
| Molecular Formula | C15H12BrNOS |
|---|---|
| Molecular Weight | 332.98 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.9823 |
| Heavy Atoms | 19 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 309732-18-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)CCSC3=CC=C(C=C3)Br |
| InChIKey | RNSBJGZCLHXEMD-UHFFFAOYSA-N |
Product Overview
2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole (CAS 309732-18-1), with molecular formula C15H12BrNOS and molecular weight 332.98 g/mol. IUPAC: 2-[2-(4-bromophenyl)sulfanylethyl]-1,3-benzoxazole.
Chemical Property Profile of 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole
Property Insights of 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole
The XLogP value of 5.0 indicates that 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.3 Ų, 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole has 0 hydrogen bond donor(s) and 3 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-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole?
The CAS number of 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole is 309732-18-1.
What is the molecular formula of 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole?
The molecular formula of 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole is C15H12BrNOS.
What is the molecular weight of 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole?
The molecular weight of 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole is 332.98 g/mol.
Where can I buy 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole?
You can request a quote for 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-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-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-{2-[(4-Bromophenyl)sulfanyl]ethyl}-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.