(Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate
TL;DR: (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate (CAS 1008904-73-1) is a chemical compound with molecular formula C26H26N4O4S and molecular weight 490.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (Z)-2-cyano-3-[1-phenyl-3-(3-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enoate
Also Known As: (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate, ethyl (Z)-2-cyano-3-[1-phenyl-3-(3-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enoate
| Molecular Formula | C26H26N4O4S |
|---|---|
| Molecular Weight | 490.17 g/mol |
| LogP | 4.18398 |
| Topological Polar Surface Area | 105.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 490.16748 |
| Heavy Atoms | 35 |
| Complexity | 1382.205 |
Chemical Identifiers
| CAS Number | 1008904-73-1 |
|---|---|
| SMILES | CCOC(=O)/C(=C\C1=CN(N=C1C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C4=CC=CC=C4)/C#N |
Product Overview
(Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate (CAS 1008904-73-1), with molecular formula C26H26N4O4S and molecular weight 490.17 g/mol. IUPAC: ethyl (Z)-2-cyano-3-[1-phenyl-3-(3-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enoate.
Chemical Property Profile of (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate
Property Insights of (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate
The XLogP value of 4.18398 indicates that (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate. Following Lipinski's Rule of Five, (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate has 0 hydrogen bond donor(s) and 6 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 (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate?
The CAS number of (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate is 1008904-73-1.
What is the molecular formula of (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate?
The molecular formula of (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate is C26H26N4O4S.
What is the molecular weight of (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate?
The molecular weight of (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate is 490.17 g/mol.
Where can I buy (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate?
You can request a quote for (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-ethyl 2-cyano-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.