![2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole structure](/static/products/489/489466-13-9.png)
2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole
TL;DR: 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole (CAS 489466-13-9) is a chemical compound with molecular formula C11H9Cl2NS2 and molecular weight 288.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,2-dichlorocyclopropyl)methylsulfanyl]-1,3-benzothiazole
Also Known As: 2-[(2,2-dichlorocyclopropyl)methylthio]benzothiazole, 2-[(2,2-dichlorocyclopropyl)methylsulfanyl]-1,3-benzothiazole, 2-(((2,2-dichlorocyclopropyl)methyl)thio)benzo[d]thiazole, 2-{[(2,2-dichlorocyclopropyl)methyl]sulfanyl}-1,3-benzothiazole
| Molecular Formula | C11H9Cl2NS2 |
|---|---|
| Molecular Weight | 288.96 g/mol |
| LogP | 4.5822 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.95535 |
| Heavy Atoms | 16 |
| Complexity | 490.43384 |
Chemical Identifiers
| CAS Number | 489466-13-9 |
|---|---|
| SMILES | C1C(C1(Cl)Cl)CSC2=NC3=CC=CC=C3S2 |
Product Overview
2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole (CAS 489466-13-9), with molecular formula C11H9Cl2NS2 and molecular weight 288.96 g/mol. IUPAC: 2-[(2,2-dichlorocyclopropyl)methylsulfanyl]-1,3-benzothiazole.
Chemical Property Profile of 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole
Property Insights of 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole
The XLogP value of 4.5822 indicates that 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole 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-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole 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 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole?
The CAS number of 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole is 489466-13-9.
What is the molecular formula of 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole?
The molecular formula of 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole is C11H9Cl2NS2.
What is the molecular weight of 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole?
The molecular weight of 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole is 288.96 g/mol.
Where can I buy 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole?
You can request a quote for 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,2-Dichlorocyclopropyl)methylthio]benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.