2-(2,2'-Bithiophen-5-ylmethylene)malononitrile
TL;DR: 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile (CAS 153308-35-1) is a chemical compound with molecular formula C12H6N2S2 and molecular weight 242.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-thiophen-2-ylthiophen-2-yl)methylidene]propanedinitrile
Also Known As: 2-(2,2'-bithiophen-5-ylmethylene)malononitrile, 2-([2,2'-Bithiophen]-5-ylmethylene)malononitrile, 2-[(5-thiophen-2-ylthiophen-2-yl)methylidene]propanedinitrile, J1.669.024D, 2-(2,2-bithiophen-5-ylmethylene)malononitrile
| Molecular Formula | C12H6N2S2 |
|---|---|
| Molecular Weight | 242.00 g/mol |
| LogP | 3.90716 |
| Topological Polar Surface Area | 47.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.99724 |
| Heavy Atoms | 16 |
| Complexity | 575.74255 |
Chemical Identifiers
| CAS Number | 153308-35-1 |
|---|---|
| SMILES | C1=CSC(=C1)C2=CC=C(S2)C=C(C#N)C#N |
Product Overview
2-(2,2'-Bithiophen-5-ylmethylene)malononitrile (CAS 153308-35-1), with molecular formula C12H6N2S2 and molecular weight 242.00 g/mol. IUPAC: 2-[(5-thiophen-2-ylthiophen-2-yl)methylidene]propanedinitrile.
Chemical Property Profile of 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile
Property Insights of 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile
The XLogP value of 3.90716 indicates that 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.58 Ų, 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile 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-(2,2'-Bithiophen-5-ylmethylene)malononitrile?
The CAS number of 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile is 153308-35-1.
What is the molecular formula of 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile?
The molecular formula of 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile is C12H6N2S2.
What is the molecular weight of 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile?
The molecular weight of 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile is 242.00 g/mol.
Where can I buy 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile?
You can request a quote for 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile 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'-Bithiophen-5-ylmethylene)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2'-Bithiophen-5-ylmethylene)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.