4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole
TL;DR: 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole (CAS 54679-74-2) is a chemical compound with molecular formula C8H6ClNOS and molecular weight 198.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-2-thiophen-2-yl-1,3-oxazole
Also Known As: 4-(chloromethyl)-2-(thiophen-2-yl)oxazole, 4-(chloromethyl)-2-thien-2-yl-1,3-oxazole, 4-(chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole, 4-(chloromethyl)-2-thiophen-2-yl-1,3-oxazole, 4-chloromethyl-2-(2-thienyl)oxazole
| Molecular Formula | C8H6ClNOS |
|---|---|
| Molecular Weight | 198.99 g/mol |
| LogP | 3.1419 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.98586 |
| Heavy Atoms | 12 |
| Complexity | 354.78137 |
Chemical Identifiers
| CAS Number | 54679-74-2 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NC(=CO2)CCl |
Product Overview
4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole (CAS 54679-74-2), with molecular formula C8H6ClNOS and molecular weight 198.99 g/mol. IUPAC: 4-(chloromethyl)-2-thiophen-2-yl-1,3-oxazole.
Chemical Property Profile of 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole
Property Insights of 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole
The XLogP value of 3.1419 indicates that 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.03 Ų, 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole 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 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole?
The CAS number of 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole is 54679-74-2.
What is the molecular formula of 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole?
The molecular formula of 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole is C8H6ClNOS.
What is the molecular weight of 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole?
The molecular weight of 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole is 198.99 g/mol.
Where can I buy 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole?
You can request a quote for 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(Chloromethyl)-2-(thiophen-2-yl)-1,3-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.