![(E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide structure](/static/products/796/796878-10-9.png)
(E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide
TL;DR: (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide (CAS 796878-10-9) is a chemical compound with molecular formula C20H23N5O2 and molecular weight 365.19 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-ethylprop-2-enamide
Also Known As: (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide, (E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethylprop-2-enamide, (2E)-3-[2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethylprop-2-enamide
| Molecular Formula | C20H23N5O2 |
|---|---|
| Molecular Weight | 365.19 g/mol |
| LogP | 2.11798 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.18518 |
| Heavy Atoms | 27 |
| Complexity | 962.4764 |
Chemical Identifiers
| CAS Number | 796878-10-9 |
|---|---|
| SMILES | CCNC(=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-ethylacrylamide (CAS 796878-10-9), with molecular formula C20H23N5O2 and molecular weight 365.19 g/mol. IUPAC: (E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethylprop-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-ethylacrylamide
Property Insights of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide
The XLogP value of 2.11798 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-ethylacrylamide. 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-ethylacrylamide. 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-ethylacrylamide 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-ethylacrylamide?
The CAS number of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide is 796878-10-9.
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-ethylacrylamide?
The molecular formula of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide is C20H23N5O2.
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-ethylacrylamide?
The molecular weight of (E)-3-(2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-ethylacrylamide is 365.19 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-ethylacrylamide?
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-ethylacrylamide 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-ethylacrylamide?
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-ethylacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.