2-(Allylthio)-2-thiazoline
TL;DR: 2-(Allylthio)-2-thiazoline (CAS 3571-74-2) is a chemical compound with molecular formula C6H9NS2 and molecular weight 159.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-2-enylsulfanyl-4,5-dihydro-1,3-thiazole
Also Known As: 2-(Allylthio)-2-thiazoline, 2-Thiazoline, 2-(allylthio)-, 2-(Allylthio)-4,5-dihydrothiazole, 2-Allylthio-2-thiazolin, 2-Allylthio-2-thiazoline
| Molecular Formula | C6H9NS2 |
|---|---|
| Molecular Weight | 159.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 63.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 159.01764 |
| Heavy Atoms | 9 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 3571-74-2 |
|---|---|
| SMILES | C=CCSC1=NCCS1 |
| InChIKey | HOULSWDLZNLUIV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Allylthio)-2-thiazoline (CAS 3571-74-2), with molecular formula C6H9NS2 and molecular weight 159.02 g/mol. IUPAC: 2-prop-2-enylsulfanyl-4,5-dihydro-1,3-thiazole.
Chemical Property Profile of 2-(Allylthio)-2-thiazoline
Property Insights of 2-(Allylthio)-2-thiazoline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Allylthio)-2-thiazoline. The TPSA of 63.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Allylthio)-2-thiazoline. Following Lipinski's Rule of Five, 2-(Allylthio)-2-thiazoline 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-(Allylthio)-2-thiazoline?
The CAS number of 2-(Allylthio)-2-thiazoline is 3571-74-2.
What is the molecular formula of 2-(Allylthio)-2-thiazoline?
The molecular formula of 2-(Allylthio)-2-thiazoline is C6H9NS2.
What is the molecular weight of 2-(Allylthio)-2-thiazoline?
The molecular weight of 2-(Allylthio)-2-thiazoline is 159.02 g/mol.
Where can I buy 2-(Allylthio)-2-thiazoline?
You can request a quote for 2-(Allylthio)-2-thiazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Allylthio)-2-thiazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(Allylthio)-2-thiazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.