![3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile structure](/static/products/1510/151013-48-8.webp)
3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile
TL;DR: 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile (CAS 151013-48-8) is a chemical compound with molecular formula C13H9N5O2 and molecular weight 267.07562 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile
Also Known As: Tyrphostin AG 568
Technical Specifications
| Molecular Formula | C13H9N5O2 |
| Molecular Weight | 267.07562 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 143.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.07562 Da |
| Heavy Atoms | 20 |
| Complexity | 487.0 |
| SMILES | C1=CC(=C(C=C1C=C(C#N)C2=C(C(=NN2)N)C#N)O)O |
| InChIKey | UESNEMVKRVCPAV-UHFFFAOYSA-N |
Chemical Property Profile of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile
Property Insights of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile. The TPSA of 143.0 Ų indicates high polarity, suggesting 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile?
The CAS number of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile is 151013-48-8.
What is the molecular formula of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile?
The molecular formula of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile is C13H9N5O2.
What is the molecular weight of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile?
The molecular weight of 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile is 267.07562 g/mol.
Where can I buy 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile?
You can request a quote for 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 3-amino-5-[1-cyano-2-(3,4-dihydroxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.