4,4'-(Thiophene-2,5-diyl)dibenzonitrile
TL;DR: 4,4'-(Thiophene-2,5-diyl)dibenzonitrile (CAS 55368-38-2) is a chemical compound with molecular formula C18H10N2S and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-(4-cyanophenyl)thiophen-2-yl]benzonitrile
Also Known As: 4,4'-(THIOPHENE-2,5-DIYL)DIBENZONITRILE, YSZC463, 4,4'-(2,5-thiophenediyl)bis-Benzonitrile, 4-[5-(4-cyanophenyl)thiophen-2-yl]benzonitrile, Benzonitrile, 4,4'-(2,5-thiophenediyl)bis-
| Molecular Formula | C18H10N2S |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | 4.82546 |
| Topological Polar Surface Area | 47.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.05646 |
| Heavy Atoms | 21 |
| Complexity | 771.97424 |
Chemical Identifiers
| CAS Number | 55368-38-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)C2=CC=C(S2)C3=CC=C(C=C3)C#N |
Product Overview
4,4'-(Thiophene-2,5-diyl)dibenzonitrile (CAS 55368-38-2), with molecular formula C18H10N2S and molecular weight 286.06 g/mol. IUPAC: 4-[5-(4-cyanophenyl)thiophen-2-yl]benzonitrile.
Chemical Property Profile of 4,4'-(Thiophene-2,5-diyl)dibenzonitrile
Property Insights of 4,4'-(Thiophene-2,5-diyl)dibenzonitrile
The XLogP value of 4.82546 indicates that 4,4'-(Thiophene-2,5-diyl)dibenzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.58 Ų, 4,4'-(Thiophene-2,5-diyl)dibenzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-(Thiophene-2,5-diyl)dibenzonitrile 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 4,4'-(Thiophene-2,5-diyl)dibenzonitrile?
The CAS number of 4,4'-(Thiophene-2,5-diyl)dibenzonitrile is 55368-38-2.
What is the molecular formula of 4,4'-(Thiophene-2,5-diyl)dibenzonitrile?
The molecular formula of 4,4'-(Thiophene-2,5-diyl)dibenzonitrile is C18H10N2S.
What is the molecular weight of 4,4'-(Thiophene-2,5-diyl)dibenzonitrile?
The molecular weight of 4,4'-(Thiophene-2,5-diyl)dibenzonitrile is 286.06 g/mol.
Where can I buy 4,4'-(Thiophene-2,5-diyl)dibenzonitrile?
You can request a quote for 4,4'-(Thiophene-2,5-diyl)dibenzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-(Thiophene-2,5-diyl)dibenzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-(Thiophene-2,5-diyl)dibenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.