![[2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile structure](/static/products/153/153391-34-5.webp)
[2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile
TL;DR: [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile (CAS 153391-34-5) is a chemical compound with molecular formula C18H15N3 and molecular weight 273.1266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-(4-methylphenyl)-1-phenylpyrazol-5-yl]acetonitrile
Also Known As: [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile|AK-087/11538930|2-[5-(4-methylphenyl)-2-phenylpyrazol-3-yl]acetonitrile|[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]acetonitrile|2-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]acetonitrile|CCG-279482
Technical Specifications
| Molecular Formula | C18H15N3 |
| Molecular Weight | 273.1266 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 41.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.1266 Da |
| Heavy Atoms | 21 |
| Complexity | 371.0 |
| SMILES | CC1=CC=C(C=C1)C2=NN(C(=C2)CC#N)C3=CC=CC=C3 |
| InChIKey | FOQQKTWTTIRLBX-UHFFFAOYSA-N |
Chemical Property Profile of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile
Property Insights of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile
The XLogP value of 3.6 indicates that [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile?
The CAS number of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile is 153391-34-5.
What is the molecular formula of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile?
The molecular formula of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile is C18H15N3.
What is the molecular weight of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile?
The molecular weight of [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile is 273.1266 g/mol.
Where can I buy [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile?
You can request a quote for [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile?
Yes, CoreyChem provides custom synthesis services for [2-Phenyl-5-(p-tolyl)-2H-pyrazol-3-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.