![(E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide structure](/static/products/796/796879-01-1.png)
(E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide
TL;DR: (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide (CAS 796879-01-1) is a chemical compound with molecular formula C19H21N5O2 and molecular weight 351.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-methylprop-2-enamide
Also Known As: (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide, (E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-methylprop-2-enamide, (2E)-3-[2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-methylprop-2-enamide
| Molecular Formula | C19H21N5O2 |
|---|---|
| Molecular Weight | 351.17 g/mol |
| LogP | 1.72788 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.16953 |
| Heavy Atoms | 26 |
| Complexity | 946.5363 |
Chemical Identifiers
| CAS Number | 796879-01-1 |
|---|---|
| SMILES | CNC(=O)/C(=C/C1=C(N=C2C=CC=CN2C1=O)N3CCCCCC3)/C#N |
Product Overview
(E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide (CAS 796879-01-1), with molecular formula C19H21N5O2 and molecular weight 351.17 g/mol. IUPAC: (E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-methylprop-2-enamide.
Chemical Property Profile of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide
Property Insights of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide
The XLogP value of 1.72788 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide. Following Lipinski's Rule of Five, (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide has 1 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 (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide?
The CAS number of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide is 796879-01-1.
What is the molecular formula of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide?
The molecular formula of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide is C19H21N5O2.
What is the molecular weight of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide?
The molecular weight of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide is 351.17 g/mol.
Where can I buy (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide?
You can request a quote for (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-methylacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.