![2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide structure](/static/products/893/893700-31-7.png)
2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide
TL;DR: 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide (CAS 893700-31-7) is a chemical compound with molecular formula C20H14N4O2 and molecular weight 342.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dioxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Also Known As: ChemDiv3_011929, IDI1_029487, BRD-K06985560-001-01-1, 2,5-DIOXO-1-PHENETHYL-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE, 2,5-dioxo-1-phenethyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
| Molecular Formula | C20H14N4O2 |
|---|---|
| Molecular Weight | 342.11 g/mol |
| LogP | 2.12378 |
| Topological Polar Surface Area | 80.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.11166 |
| Heavy Atoms | 26 |
| Complexity | 1280.9309 |
Chemical Identifiers
| CAS Number | 893700-31-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C3=C(C=C(C2=O)C#N)C(=O)N4C=CC=CC4=N3 |
Product Overview
2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide (CAS 893700-31-7), with molecular formula C20H14N4O2 and molecular weight 342.11 g/mol. IUPAC: 2,6-dioxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile.
Chemical Property Profile of 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide
Property Insights of 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide
The XLogP value of 2.12378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide. The TPSA of 80.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide. Following Lipinski's Rule of Five, 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide 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 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide?
The CAS number of 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide is 893700-31-7.
What is the molecular formula of 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide?
The molecular formula of 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide is C20H14N4O2.
What is the molecular weight of 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide?
The molecular weight of 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide is 342.11 g/mol.
Where can I buy 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide?
You can request a quote for 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dioxo-1-phenethyl-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidin-3-YL cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.