2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole
TL;DR: 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole (CAS 7464-61-1) is a chemical compound with molecular formula C11H11NOS2 and molecular weight 237.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-ethenoxyethylsulfanyl)-1,3-benzothiazole
Also Known As: 2-(2-ethenoxyethylsulfanyl)-1,3-benzothiazole, 2-{[2-(Ethenyloxy)ethyl]sulfanyl}-1,3-benzothiazole
| Molecular Formula | C11H11NOS2 |
|---|---|
| Molecular Weight | 237.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 75.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.02821 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 7464-61-1 |
|---|---|
| SMILES | C=COCCSC1=NC2=CC=CC=C2S1 |
| InChIKey | IBOPXHXXGRJIKB-UHFFFAOYSA-N |
Product Overview
2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole (CAS 7464-61-1), with molecular formula C11H11NOS2 and molecular weight 237.03 g/mol. IUPAC: 2-(2-ethenoxyethylsulfanyl)-1,3-benzothiazole.
Chemical Property Profile of 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole
Property Insights of 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole. Following Lipinski's Rule of Five, 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole has 0 hydrogen bond donor(s) and 4 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-Ethenoxyethylsulfanyl)-1,3-benzothiazole?
The CAS number of 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole is 7464-61-1.
What is the molecular formula of 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole?
The molecular formula of 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole is C11H11NOS2.
What is the molecular weight of 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole?
The molecular weight of 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole is 237.03 g/mol.
Where can I buy 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole?
You can request a quote for 2-(2-Ethenoxyethylsulfanyl)-1,3-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-Ethenoxyethylsulfanyl)-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Ethenoxyethylsulfanyl)-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.