4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile
TL;DR: 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile (CAS 724742-77-2) is a chemical compound with molecular formula C16H10N2S and molecular weight 262.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-phenyl-1,3-thiazol-4-yl)benzonitrile
Also Known As: 4-(2-phenyl-1,3-thiazol-4-yl)benzonitrile, 4-(2-Phenylthiazol-4-yl)benzonitrile, AQ-776/42801542, 4-(2-phenyl-1,3-thiazol-4-yl)benzenecarbonitrile
| Molecular Formula | C16H10N2S |
|---|---|
| Molecular Weight | 262.06 g/mol |
| LogP | 4.34878 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.05646 |
| Heavy Atoms | 19 |
| Complexity | 721.44543 |
Chemical Identifiers
| CAS Number | 724742-77-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CS2)C3=CC=C(C=C3)C#N |
Product Overview
4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile (CAS 724742-77-2), with molecular formula C16H10N2S and molecular weight 262.06 g/mol. IUPAC: 4-(2-phenyl-1,3-thiazol-4-yl)benzonitrile.
Chemical Property Profile of 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile
Property Insights of 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile
The XLogP value of 4.34878 indicates that 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile 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-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile?
The CAS number of 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile is 724742-77-2.
What is the molecular formula of 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile?
The molecular formula of 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile is C16H10N2S.
What is the molecular weight of 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile?
The molecular weight of 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile is 262.06 g/mol.
Where can I buy 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile?
You can request a quote for 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Phenyl-1,3-thiazol-4-yl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.