![2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile structure](/static/products/875/875661-82-8.png)
2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile
TL;DR: 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile (CAS 875661-82-8) is a chemical compound with molecular formula C14H9N3OS2 and molecular weight 299.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile
Also Known As: 2-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile, 2-[(4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetonitrile, 2-[(4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetonitrile, [(4-Oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile, 2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanenitrile
| Molecular Formula | C14H9N3OS2 |
|---|---|
| Molecular Weight | 299.02 g/mol |
| LogP | 3.06288 |
| Topological Polar Surface Area | 58.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.0187 |
| Heavy Atoms | 20 |
| Complexity | 846.2218 |
Chemical Identifiers
| CAS Number | 875661-82-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC#N)SC=C3 |
Product Overview
2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile (CAS 875661-82-8), with molecular formula C14H9N3OS2 and molecular weight 299.02 g/mol. IUPAC: 2-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile.
Chemical Property Profile of 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile
Property Insights of 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile
The XLogP value of 3.06288 indicates that 2-(4-Oxo-3-phenylthieno[2,3-d]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 58.68 Ų, 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile 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-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile?
The CAS number of 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile is 875661-82-8.
What is the molecular formula of 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile?
The molecular formula of 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile is C14H9N3OS2.
What is the molecular weight of 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile?
The molecular weight of 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile is 299.02 g/mol.
Where can I buy 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile?
You can request a quote for 2-(4-Oxo-3-phenylthieno[2,3-d]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-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.