![[(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile structure](/static/products/620/620104-72-5.png)
[(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile
TL;DR: [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile (CAS 620104-72-5) is a chemical compound with molecular formula C18H10N4O2 and molecular weight 314.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile
Also Known As: [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile|2-((4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)malononitrile|2-[(4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile
| Molecular Formula | C18H10N4O2 |
|---|---|
| Molecular Weight | 314.08 g/mol |
| LogP | 2.91736 |
| Topological Polar Surface Area | 91.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.08038 |
| Heavy Atoms | 24 |
| Complexity | 1054.0996 |
Chemical Identifiers
| CAS Number | 620104-72-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C#N |
Product Overview
[(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile (CAS 620104-72-5), with molecular formula C18H10N4O2 and molecular weight 314.08 g/mol. IUPAC: 2-[(4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile.
Chemical Property Profile of [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile
Property Insights of [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile
The XLogP value of 2.91736 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile. The TPSA of 91.18 Ų falls within the moderate polarity range, balancing permeability and solubility for [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile. Following Lipinski's Rule of Five, [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile 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 [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile?
The CAS number of [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile is 620104-72-5.
What is the molecular formula of [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile?
The molecular formula of [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile is C18H10N4O2.
What is the molecular weight of [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile?
The molecular weight of [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile is 314.08 g/mol.
Where can I buy [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile?
You can request a quote for [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for [(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.