2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole
TL;DR: 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole (CAS 334501-87-0) is a chemical compound with molecular formula C16H15NO2S and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-methylphenoxy)ethylsulfanyl]-1,3-benzoxazole
Also Known As: 2-(2-p-Tolyloxy-ethylsulfanyl)-benzooxazole, BAS 01063668, 2-[2-(4-methylphenoxy)ethylsulfanyl]-1,3-benzoxazole, 2-{[2-(4-methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole, AB00145229-03
| Molecular Formula | C16H15NO2S |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | 4.30732 |
| Topological Polar Surface Area | 35.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 285.08234 |
| Heavy Atoms | 20 |
| Complexity | 658.0232 |
Chemical Identifiers
| CAS Number | 334501-87-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3O2 |
Product Overview
2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole (CAS 334501-87-0), with molecular formula C16H15NO2S and molecular weight 285.08 g/mol. IUPAC: 2-[2-(4-methylphenoxy)ethylsulfanyl]-1,3-benzoxazole.
Chemical Property Profile of 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole
Property Insights of 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole
The XLogP value of 4.30732 indicates that 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.26 Ų, 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole 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 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole?
The CAS number of 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole is 334501-87-0.
What is the molecular formula of 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole?
The molecular formula of 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole is C16H15NO2S.
What is the molecular weight of 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole?
The molecular weight of 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole is 285.08 g/mol.
Where can I buy 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole?
You can request a quote for 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-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-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-(4-Methylphenoxy)ethyl]sulfanyl}-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.