Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-
TL;DR: Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- (CAS 36687-69-1) is a chemical compound with molecular formula C13H8S2 and molecular weight 228.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-1-ynyl-5-(2-thiophen-2-ylethynyl)thiophene
Also Known As: MEGxp0_001539, ACon0_000326, thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-, 2-prop-1-yn-1-yl-5-(2-thienylethynyl)thiophene, 5-prop-1-ynyl-2,2'-ethynediyl-bis-thiophene
| Molecular Formula | C13H8S2 |
|---|---|
| Molecular Weight | 228.01 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.00674 |
| Heavy Atoms | 15 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 36687-69-1 |
|---|---|
| SMILES | CC#CC1=CC=C(S1)C#CC2=CC=CS2 |
| InChIKey | ZGJINZFFSXDNKV-UHFFFAOYSA-N |
Product Overview
Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- (CAS 36687-69-1), with molecular formula C13H8S2 and molecular weight 228.01 g/mol. IUPAC: 2-prop-1-ynyl-5-(2-thiophen-2-ylethynyl)thiophene.
Chemical Property Profile of Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-
Property Insights of Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-
The XLogP value of 4.2 indicates that Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.5 Ų, Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- 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 Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-?
The CAS number of Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- is 36687-69-1.
What is the molecular formula of Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-?
The molecular formula of Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- is C13H8S2.
What is the molecular weight of Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-?
The molecular weight of Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- is 228.01 g/mol.
Where can I buy Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-?
You can request a quote for Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)-?
Yes, KEHONG BIO provides custom synthesis services for Thiophene, 2-(1-propynyl)-5-(2-thienylethynyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.