![2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile structure](/static/products/7309/730951-46-9.webp)
2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile
TL;DR: 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile (CAS 730951-46-9) is a chemical compound with molecular formula C11H6F2N2S and molecular weight 236.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]acetonitrile
Also Known As: 2-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]acetonitrile, [4-(2,5-Difluoro-phenyl)-thiazol-2-yl]-acetonitrile
| Molecular Formula | C11H6F2N2S |
|---|---|
| Molecular Weight | 236.02 g/mol |
| LogP | 3.15438 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.02197 |
| Heavy Atoms | 16 |
| Complexity | 557.3525 |
Chemical Identifiers
| CAS Number | 730951-46-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)C2=CSC(=N2)CC#N)F |
Product Overview
2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile (CAS 730951-46-9), with molecular formula C11H6F2N2S and molecular weight 236.02 g/mol. IUPAC: 2-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]acetonitrile.
Chemical Property Profile of 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile
Property Insights of 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile
The XLogP value of 3.15438 indicates that 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(2,5-Difluorophenyl)-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-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile?
The CAS number of 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile is 730951-46-9.
What is the molecular formula of 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile?
The molecular formula of 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile is C11H6F2N2S.
What is the molecular weight of 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile?
The molecular weight of 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile is 236.02 g/mol.
Where can I buy 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile?
You can request a quote for 2-[4-(2,5-Difluorophenyl)-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-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(2,5-Difluorophenyl)-1,3-thiazol-2-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.