![3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide structure](/static/products/956/956236-43-4.png)
3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide
TL;DR: 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide (CAS 956236-43-4) is a chemical compound with molecular formula C22H18Cl2N4O3 and molecular weight 456.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[5-chloro-1-(3-chlorophenyl)-3-methylpyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide
Also Known As: 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide, (E)-3-[5-chloro-1-(3-chlorophenyl)-3-methylpyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide
| Molecular Formula | C22H18Cl2N4O3 |
|---|---|
| Molecular Weight | 456.08 g/mol |
| LogP | 5.0504 |
| Topological Polar Surface Area | 89.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.0756 |
| Heavy Atoms | 31 |
| Complexity | 1211.9504 |
Chemical Identifiers
| CAS Number | 956236-43-4 |
|---|---|
| SMILES | CC1=NN(C(=C1/C=C(\C#N)/C(=O)NC2=CC(=C(C=C2)OC)OC)Cl)C3=CC(=CC=C3)Cl |
Product Overview
3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide (CAS 956236-43-4), with molecular formula C22H18Cl2N4O3 and molecular weight 456.08 g/mol. IUPAC: (E)-3-[5-chloro-1-(3-chlorophenyl)-3-methylpyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide.
Chemical Property Profile of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide
Property Insights of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide
The XLogP value of 5.0504 indicates that 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide?
The CAS number of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide is 956236-43-4.
What is the molecular formula of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide?
The molecular formula of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide is C22H18Cl2N4O3.
What is the molecular weight of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide?
The molecular weight of 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide is 456.08 g/mol.
Where can I buy 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide?
You can request a quote for 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-[5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.