![2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile structure](/static/products/3392/339278-45-4.webp)
2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile
TL;DR: 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile (CAS 339278-45-4) is a chemical compound with molecular formula C14H9Cl2N3S and molecular weight 320.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-(2,4-dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile
Also Known As: 2-[4-[2-(2,4-dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile, 2-{[4-(2,4-dichlorostyryl)-2-pyrimidinyl]sulfanyl}acetonitrile
| Molecular Formula | C14H9Cl2N3S |
|---|---|
| Molecular Weight | 320.99 g/mol |
| LogP | 4.56948 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.9894 |
| Heavy Atoms | 20 |
| Complexity | 680.3595 |
Chemical Identifiers
| CAS Number | 339278-45-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C=CC2=NC(=NC=C2)SCC#N |
Product Overview
2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile (CAS 339278-45-4), with molecular formula C14H9Cl2N3S and molecular weight 320.99 g/mol. IUPAC: 2-[4-[2-(2,4-dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile.
Chemical Property Profile of 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile
Property Insights of 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile
The XLogP value of 4.56948 indicates that 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.57 Ų, 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile 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 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile?
The CAS number of 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile is 339278-45-4.
What is the molecular formula of 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile?
The molecular formula of 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile is C14H9Cl2N3S.
What is the molecular weight of 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile?
The molecular weight of 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile is 320.99 g/mol.
Where can I buy 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile?
You can request a quote for 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile 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-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-[2-(2,4-Dichlorophenyl)ethenyl]pyrimidin-2-yl]sulfanylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.