![2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile structure](/static/products/3391/339106-55-7.webp)
2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile
TL;DR: 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile (CAS 339106-55-7) is a chemical compound with molecular formula C10H5Cl2N3S2 and molecular weight 300.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,5-dichlorothiophen-3-yl)pyrimidin-2-yl]sulfanylacetonitrile
Also Known As: 2-{[4-(2,5-dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile, 2-[4-(2,5-dichlorothiophen-3-yl)pyrimidin-2-yl]sulfanylacetonitrile, 2-{[4-(2,5-dichlorothiophen-3-yl)pyrimidin-2-yl]sulfanyl}acetonitrile, 2-[4-(2,5-dichloro-3-thienyl)pyrimidin-2-yl]sulfanylacetonitrile, 2-([4-(2,5-DICHLORO-3-THIENYL)-2-PYRIMIDINYL]SULFANYL)ACETONITRILE
| Molecular Formula | C10H5Cl2N3S2 |
|---|---|
| Molecular Weight | 300.93 g/mol |
| LogP | 4.12758 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.9302 |
| Heavy Atoms | 17 |
| Complexity | 577.1702 |
Chemical Identifiers
| CAS Number | 339106-55-7 |
|---|---|
| SMILES | C1=CN=C(N=C1C2=C(SC(=C2)Cl)Cl)SCC#N |
Product Overview
2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile (CAS 339106-55-7), with molecular formula C10H5Cl2N3S2 and molecular weight 300.93 g/mol. IUPAC: 2-[4-(2,5-dichlorothiophen-3-yl)pyrimidin-2-yl]sulfanylacetonitrile.
Chemical Property Profile of 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile
Property Insights of 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile
The XLogP value of 4.12758 indicates that 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile 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-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[4-(2,5-Dichloro-3-thienyl)-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-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
The CAS number of 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile is 339106-55-7.
What is the molecular formula of 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
The molecular formula of 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile is C10H5Cl2N3S2.
What is the molecular weight of 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
The molecular weight of 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile is 300.93 g/mol.
Where can I buy 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
You can request a quote for 2-{[4-(2,5-Dichloro-3-thienyl)-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-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(2,5-Dichloro-3-thienyl)-2-pyrimidinyl]sulfanyl}acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.