4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1)
TL;DR: 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) (CAS 39238-07-8) is a chemical compound with molecular formula C5H7Cl2NS and molecular weight 182.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride
Also Known As: 4-(Chloromethyl)-2-methylthiazole hydrochloride, 4-Chloromethyl-2-methylthiazole hydrochloride, 4-(chloromethyl)-2-methyl-1,3-thiazole Hydrochloride, 4-(Chloromethyl)-2-methylthiazole HCl, 1-iodo-4-(phenylsulfonyl)benzene
| Molecular Formula | C5H7Cl2NS |
|---|---|
| Molecular Weight | 182.97 g/mol |
| LogP | 2.61212 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.96762 |
| Heavy Atoms | 9 |
| Complexity | 175.22086 |
Chemical Identifiers
| CAS Number | 39238-07-8 |
|---|---|
| SMILES | CC1=NC(=CS1)CCl.Cl |
Product Overview
4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) (CAS 39238-07-8), with molecular formula C5H7Cl2NS and molecular weight 182.97 g/mol. IUPAC: 4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride.
Chemical Property Profile of 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1)
Property Insights of 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1)
The XLogP value of 2.61212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 12.89 Ų, 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) 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-methyl-1,3-thiazole--hydrogen chloride (1/1)?
The CAS number of 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) is 39238-07-8.
What is the molecular formula of 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1)?
The molecular formula of 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) is C5H7Cl2NS.
What is the molecular weight of 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1)?
The molecular weight of 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) is 182.97 g/mol.
Where can I buy 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1)?
You can request a quote for 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) 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-methyl-1,3-thiazole--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 4-(Chloromethyl)-2-methyl-1,3-thiazole--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.