![2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile structure](/static/products/6922/692287-29-9.webp)
2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile
TL;DR: 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile (CAS 692287-29-9) is a chemical compound with molecular formula C10H7N3OS and molecular weight 217.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(furan-2-yl)pyrimidin-2-yl]sulfanylacetonitrile
Also Known As: 2-{[4-(2-furyl)-2-pyrimidinyl]sulfanyl}acetonitrile, 2-[4-(2-furyl)pyrimidin-2-yl]sulfanylacetonitrile, 2-{[4-(furan-2-yl)pyrimidin-2-yl]sulfanyl}acetonitrile, 2-[4-(furan-2-yl)pyrimidin-2-yl]sulfanylacetonitrile, 6T-0071
| Molecular Formula | C10H7N3OS |
|---|---|
| Molecular Weight | 217.03 g/mol |
| LogP | 2.35228 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.03099 |
| Heavy Atoms | 15 |
| Complexity | 475.66275 |
Chemical Identifiers
| CAS Number | 692287-29-9 |
|---|---|
| SMILES | C1=COC(=C1)C2=NC(=NC=C2)SCC#N |
Product Overview
2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile (CAS 692287-29-9), with molecular formula C10H7N3OS and molecular weight 217.03 g/mol. IUPAC: 2-[4-(furan-2-yl)pyrimidin-2-yl]sulfanylacetonitrile.
Chemical Property Profile of 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile
Property Insights of 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile
The XLogP value of 2.35228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile. The TPSA of 62.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile. Following Lipinski's Rule of Five, 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile has 0 hydrogen bond donor(s) and 5 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-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
The CAS number of 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile is 692287-29-9.
What is the molecular formula of 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
The molecular formula of 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile is C10H7N3OS.
What is the molecular weight of 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
The molecular weight of 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile is 217.03 g/mol.
Where can I buy 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
You can request a quote for 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}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-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(2-Furyl)-2-pyrimidinyl]sulfanyl}acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.