![1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide structure](/static/products/116/1164556-67-5.png)
1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide
TL;DR: 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide (CAS 1164556-67-5) is a chemical compound with molecular formula C23H21N5O4S and molecular weight 463.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide
Also Known As: 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide, 1-{3-[(1E)-2-(benzenesulfonyl)-2-cyanoeth-1-en-1-yl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide, 1-[3-[(E)-2-besyl-2-cyano-vinyl]-4-keto-pyrido[1,2-a]pyrimidin-2-yl]isonipecotamide, (E)-1-(3-(2-cyano-2-(phenylsulfonyl)vinyl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide, 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxo-2-pyrido[1,2-a]pyrimidinyl]-4-piperidinecarboxamide
| Molecular Formula | C23H21N5O4S |
|---|---|
| Molecular Weight | 463.13 g/mol |
| LogP | 1.73458 |
| Topological Polar Surface Area | 138.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 463.13144 |
| Heavy Atoms | 33 |
| Complexity | 1447.6903 |
Chemical Identifiers
| CAS Number | 1164556-67-5 |
|---|---|
| SMILES | C1CN(CCC1C(=O)N)C2=C(C(=O)N3C=CC=CC3=N2)/C=C(\C#N)/S(=O)(=O)C4=CC=CC=C4 |
Product Overview
1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide (CAS 1164556-67-5), with molecular formula C23H21N5O4S and molecular weight 463.13 g/mol. IUPAC: 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide.
Chemical Property Profile of 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide
Property Insights of 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide
The XLogP value of 1.73458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide. The TPSA of 138.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide. Following Lipinski's Rule of Five, 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide 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 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide?
The CAS number of 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide is 1164556-67-5.
What is the molecular formula of 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide?
The molecular formula of 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide is C23H21N5O4S.
What is the molecular weight of 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide?
The molecular weight of 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide is 463.13 g/mol.
Where can I buy 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide?
You can request a quote for 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.