2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-
TL;DR: 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- (CAS 33315-13-8) is a chemical compound with molecular formula C7H9NS2 and molecular weight 171.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-3-methanimidoylthiophene-2-thiol
Also Known As: 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-, 5-ethyl-3-methanimidoylthiophene-2-thiol, 2-mercapto-5-ethyl-3-thenylideneimine, 3-(aminomethylidene)-5-ethylthiophene-2-thione, 5-ethyl-3-(iminomethyl)-2-thiophenethiol
| Molecular Formula | C7H9NS2 |
|---|---|
| Molecular Weight | 171.02 g/mol |
| LogP | 2.59687 |
| Topological Polar Surface Area | 23.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.01764 |
| Heavy Atoms | 10 |
| Complexity | 239.75418 |
Chemical Identifiers
| CAS Number | 33315-13-8 |
|---|---|
| SMILES | CCC1=CC(=C(S1)S)C=N |
Product Overview
2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- (CAS 33315-13-8), with molecular formula C7H9NS2 and molecular weight 171.02 g/mol. IUPAC: 5-ethyl-3-methanimidoylthiophene-2-thiol.
Chemical Property Profile of 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-
Property Insights of 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-
The XLogP value of 2.59687 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-. With a topological polar surface area (TPSA) of 23.85 Ų, 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- has 2 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-Thiophenethiol, 5-ethyl-3-(iminomethyl)-?
The CAS number of 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- is 33315-13-8.
What is the molecular formula of 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-?
The molecular formula of 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- is C7H9NS2.
What is the molecular weight of 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-?
The molecular weight of 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- is 171.02 g/mol.
Where can I buy 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-?
You can request a quote for 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiophenethiol, 5-ethyl-3-(iminomethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.