1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone
TL;DR: 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone (CAS 957510-23-5) is a chemical compound with molecular formula C12H11ClN2O and molecular weight 234.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone
Also Known As: 1-(4-chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone, 1-(4-chloropyrazolyl)-2-(4-methylphenyl)ethan-1-one, 1-(4-chloro-1H-pyrazol-1-yl)-2-(4-methylphenyl)ethanone, 1-(4-CHLORO-1H-PYRAZOL-1-YL)-2-(4-METHYLPHENYL)-1-ETHANONE
| Molecular Formula | C12H11ClN2O |
|---|---|
| Molecular Weight | 234.06 g/mol |
| LogP | 2.72782 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.05598 |
| Heavy Atoms | 16 |
| Complexity | 501.99225 |
Chemical Identifiers
| CAS Number | 957510-23-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC(=O)N2C=C(C=N2)Cl |
Product Overview
1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone (CAS 957510-23-5), with molecular formula C12H11ClN2O and molecular weight 234.06 g/mol. IUPAC: 1-(4-chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone.
Chemical Property Profile of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone
Property Insights of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone
The XLogP value of 2.72782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone. With a topological polar surface area (TPSA) of 34.89 Ų, 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone 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
Frequently Asked Questions
What is the CAS number of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone?
The CAS number of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone is 957510-23-5.
What is the molecular formula of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone?
The molecular formula of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone is C12H11ClN2O.
What is the molecular weight of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone?
The molecular weight of 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone is 234.06 g/mol.
Where can I buy 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone?
You can request a quote for 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloropyrazol-1-yl)-2-(4-methylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.