2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile
TL;DR: 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile (CAS 402954-59-0) is a chemical compound with molecular formula C16H14N2S and molecular weight 266.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile
Also Known As: IFLab1_004218, 2-cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile, BAS 04796242, Cyclopentylidene-(4-phenyl-thiazol-2-yl)-acetonitrile, J2.916.761C
| Molecular Formula | C16H14N2S |
|---|---|
| Molecular Weight | 266.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.08777 |
| Heavy Atoms | 19 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 402954-59-0 |
|---|---|
| SMILES | C1CCC(=C(C#N)C2=NC(=CS2)C3=CC=CC=C3)C1 |
| InChIKey | YFZSYSXOFKILBF-UHFFFAOYSA-N |
Product Overview
2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile (CAS 402954-59-0), with molecular formula C16H14N2S and molecular weight 266.09 g/mol. IUPAC: 2-cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile.
Chemical Property Profile of 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile
Property Insights of 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile
The XLogP value of 3.8 indicates that 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile. Following Lipinski's Rule of Five, 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile 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-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
The CAS number of 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile is 402954-59-0.
What is the molecular formula of 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
The molecular formula of 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile is C16H14N2S.
What is the molecular weight of 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
The molecular weight of 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile is 266.09 g/mol.
Where can I buy 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
You can request a quote for 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclopentylidene-2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.