2-Benzyl-4-chloromethylthiazole
TL;DR: 2-Benzyl-4-chloromethylthiazole (CAS 36916-36-6) is a chemical compound with molecular formula C11H10ClNS and molecular weight 223.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-4-(chloromethyl)-1,3-thiazole
Also Known As: 2-benzyl-4-(chloromethyl)-1,3-thiazole, 2-Benzyl-4-chloromethylthiazole, 2-benzyl-4-(chloromethyl)thiazole, 4-(Chloromethyl)-2-(phenylmethyl)thiazole, Thiazole, 4-(chloromethyl)-2-(phenylmethyl)-
| Molecular Formula | C11H10ClNS |
|---|---|
| Molecular Weight | 223.02 g/mol |
| LogP | 3.4727 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.02225 |
| Heavy Atoms | 14 |
| Complexity | 396.6796 |
Chemical Identifiers
| CAS Number | 36916-36-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NC(=CS2)CCl |
Product Overview
2-Benzyl-4-chloromethylthiazole (CAS 36916-36-6), with molecular formula C11H10ClNS and molecular weight 223.02 g/mol. IUPAC: 2-benzyl-4-(chloromethyl)-1,3-thiazole.
Chemical Property Profile of 2-Benzyl-4-chloromethylthiazole
Property Insights of 2-Benzyl-4-chloromethylthiazole
The XLogP value of 3.4727 indicates that 2-Benzyl-4-chloromethylthiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 2-Benzyl-4-chloromethylthiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-4-chloromethylthiazole 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 2-Benzyl-4-chloromethylthiazole?
The CAS number of 2-Benzyl-4-chloromethylthiazole is 36916-36-6.
What is the molecular formula of 2-Benzyl-4-chloromethylthiazole?
The molecular formula of 2-Benzyl-4-chloromethylthiazole is C11H10ClNS.
What is the molecular weight of 2-Benzyl-4-chloromethylthiazole?
The molecular weight of 2-Benzyl-4-chloromethylthiazole is 223.02 g/mol.
Where can I buy 2-Benzyl-4-chloromethylthiazole?
You can request a quote for 2-Benzyl-4-chloromethylthiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-4-chloromethylthiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-4-chloromethylthiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.