4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole
TL;DR: 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole (CAS 668476-91-3) is a chemical compound with molecular formula C13H14ClNS and molecular weight 251.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole
Also Known As: 4-chloromethyl-2-(4-isopropyl-phenyl)-thiazole, Thiazole, 4-(chloromethyl)-2-[4-(1-methylethyl)phenyl]-, 4-(chloromethyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole
| Molecular Formula | C13H14ClNS |
|---|---|
| Molecular Weight | 251.05 g/mol |
| LogP | 4.6723 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.05354 |
| Heavy Atoms | 16 |
| Complexity | 459.03976 |
Chemical Identifiers
| CAS Number | 668476-91-3 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2=NC(=CS2)CCl |
Product Overview
4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole (CAS 668476-91-3), with molecular formula C13H14ClNS and molecular weight 251.05 g/mol. IUPAC: 4-(chloromethyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole.
Chemical Property Profile of 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole
Property Insights of 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole
The XLogP value of 4.6723 indicates that 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole 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 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole?
The CAS number of 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole is 668476-91-3.
What is the molecular formula of 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole?
The molecular formula of 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole is C13H14ClNS.
What is the molecular weight of 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole?
The molecular weight of 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole is 251.05 g/mol.
Where can I buy 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole?
You can request a quote for 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole 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-(4-isopropyl-phenyl)-thiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloromethyl-2-(4-isopropyl-phenyl)-thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.