![(E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate structure](/static/products/799/799776-19-5.png)
(E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate
TL;DR: (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate (CAS 799776-19-5) is a chemical compound with molecular formula C20H21N5O4 and molecular weight 395.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-[2-(4-carbamoylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate
Also Known As: (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate, ethyl (2E)-3-[2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate, ethyl (E)-3-[2-(4-carbamoylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate
| Molecular Formula | C20H21N5O4 |
|---|---|
| Molecular Weight | 395.16 g/mol |
| LogP | 0.86628 |
| Topological Polar Surface Area | 130.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.15936 |
| Heavy Atoms | 29 |
| Complexity | 1074.4486 |
Chemical Identifiers
| CAS Number | 799776-19-5 |
|---|---|
| SMILES | CCOC(=O)/C(=C/C1=C(N=C2C=CC=CN2C1=O)N3CCC(CC3)C(=O)N)/C#N |
Product Overview
(E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate (CAS 799776-19-5), with molecular formula C20H21N5O4 and molecular weight 395.16 g/mol. IUPAC: ethyl (E)-3-[2-(4-carbamoylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate.
Chemical Property Profile of (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate
Property Insights of (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate
The XLogP value of 0.86628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate. The TPSA of 130.79 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate. Following Lipinski's Rule of Five, (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate has 1 hydrogen bond donor(s) and 7 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)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate?
The CAS number of (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate is 799776-19-5.
What is the molecular formula of (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate?
The molecular formula of (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate is C20H21N5O4.
What is the molecular weight of (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate?
The molecular weight of (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate is 395.16 g/mol.
Where can I buy (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate?
You can request a quote for (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 3-(2-(4-carbamoylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.