4-(Chloromethyl)-2-isopropyl-1,3-thiazole
TL;DR: 4-(Chloromethyl)-2-isopropyl-1,3-thiazole (CAS 40516-57-2) is a chemical compound with molecular formula C7H10ClNS and molecular weight 175.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-2-propan-2-yl-1,3-thiazole
Also Known As: 4-(Chloromethyl)-2-isopropylthiazole, 4-(chloromethyl)-2-isopropyl-1,3-thiazole, 4-(chloromethyl)-2-propan-2-yl-1,3-thiazole, 4-chloromethyl-2-isopropylthiazole, 2-Isopropyl-4-(chloromethyl)thiazole
| Molecular Formula | C7H10ClNS |
|---|---|
| Molecular Weight | 175.02 g/mol |
| LogP | 3.0053 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.02225 |
| Heavy Atoms | 10 |
| Complexity | 207.12595 |
Chemical Identifiers
| CAS Number | 40516-57-2 |
|---|---|
| SMILES | CC(C)C1=NC(=CS1)CCl |
Product Overview
4-(Chloromethyl)-2-isopropyl-1,3-thiazole (CAS 40516-57-2), with molecular formula C7H10ClNS and molecular weight 175.02 g/mol. IUPAC: 4-(chloromethyl)-2-propan-2-yl-1,3-thiazole.
Chemical Property Profile of 4-(Chloromethyl)-2-isopropyl-1,3-thiazole
Property Insights of 4-(Chloromethyl)-2-isopropyl-1,3-thiazole
The XLogP value of 3.0053 indicates that 4-(Chloromethyl)-2-isopropyl-1,3-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-isopropyl-1,3-thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Chloromethyl)-2-isopropyl-1,3-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-isopropyl-1,3-thiazole?
The CAS number of 4-(Chloromethyl)-2-isopropyl-1,3-thiazole is 40516-57-2.
What is the molecular formula of 4-(Chloromethyl)-2-isopropyl-1,3-thiazole?
The molecular formula of 4-(Chloromethyl)-2-isopropyl-1,3-thiazole is C7H10ClNS.
What is the molecular weight of 4-(Chloromethyl)-2-isopropyl-1,3-thiazole?
The molecular weight of 4-(Chloromethyl)-2-isopropyl-1,3-thiazole is 175.02 g/mol.
Where can I buy 4-(Chloromethyl)-2-isopropyl-1,3-thiazole?
You can request a quote for 4-(Chloromethyl)-2-isopropyl-1,3-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-isopropyl-1,3-thiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(Chloromethyl)-2-isopropyl-1,3-thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.