![5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile structure](/static/products/4007/400753-06-2.webp)
5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
TL;DR: 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile (CAS 400753-06-2) is a chemical compound with molecular formula C15H11Cl2N5O and molecular weight 347.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile
Also Known As: 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile, 5-amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile
| Molecular Formula | C15H11Cl2N5O |
|---|---|
| Molecular Weight | 347.03 g/mol |
| LogP | 2.70026 |
| Topological Polar Surface Area | 111.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.03406 |
| Heavy Atoms | 23 |
| Complexity | 857.9729 |
Chemical Identifiers
| CAS Number | 400753-06-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=CC2=NN(C(=C2C#N)N)CCO)C#N |
Product Overview
5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile (CAS 400753-06-2), with molecular formula C15H11Cl2N5O and molecular weight 347.03 g/mol. IUPAC: 5-amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile.
Chemical Property Profile of 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Property Insights of 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
The XLogP value of 2.70026 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile. The TPSA of 111.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile has 2 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 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile?
The CAS number of 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile is 400753-06-2.
What is the molecular formula of 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile?
The molecular formula of 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile is C15H11Cl2N5O.
What is the molecular weight of 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile?
The molecular weight of 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile is 347.03 g/mol.
Where can I buy 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile?
You can request a quote for 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-3-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.