![3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile structure](/static/products/860/860648-95-9.png)
3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile
TL;DR: 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile (CAS 860648-95-9) is a chemical compound with molecular formula C11H7ClN2OS and molecular weight 250.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-chloro-1,3-thiazol-5-yl)methoxy]benzonitrile
Also Known As: 3-[(2-chloro-1,3-thiazol-5-yl)methoxy]benzonitrile, 3-[(2-chloro-1,3-thiazol-5-yl)methoxy]benzenecarbonitrile, 3-((2-Chlorothiazol-5-yl)methoxy)benzonitrile, 3-[(2-chlorothiazol-5-yl)methoxy]benzonitrile, 10X-0825
| Molecular Formula | C11H7ClN2OS |
|---|---|
| Molecular Weight | 250.00 g/mol |
| LogP | 3.24718 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.99677 |
| Heavy Atoms | 16 |
| Complexity | 532.776 |
Chemical Identifiers
| CAS Number | 860648-95-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OCC2=CN=C(S2)Cl)C#N |
Product Overview
3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile (CAS 860648-95-9), with molecular formula C11H7ClN2OS and molecular weight 250.00 g/mol. IUPAC: 3-[(2-chloro-1,3-thiazol-5-yl)methoxy]benzonitrile.
Chemical Property Profile of 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile
Property Insights of 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile
The XLogP value of 3.24718 indicates that 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile 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 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile?
The CAS number of 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile is 860648-95-9.
What is the molecular formula of 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile?
The molecular formula of 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile is C11H7ClN2OS.
What is the molecular weight of 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile?
The molecular weight of 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile is 250.00 g/mol.
Where can I buy 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile?
You can request a quote for 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-Chloro-1,3-thiazol-5-yl)methoxy]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.