Pirazolac
TL;DR: Pirazolac (CAS 71002-09-0) is a chemical compound with molecular formula C17H12ClFN2O2 and molecular weight 330.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-3-yl]acetic acid
Also Known As: PIRAZOLAC, Pirazolaco, Pirazolacum, Pirazolacum [INN-Latin], Pirazolaco [INN-Spanish]
| Molecular Formula | C17H12ClFN2O2 |
|---|---|
| Molecular Weight | 330.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.05713 |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 71002-09-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CN(N=C2CC(=O)O)C3=CC=C(C=C3)F)Cl |
| InChIKey | YAMFWQIVVMITPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pirazolac (CAS 71002-09-0), with molecular formula C17H12ClFN2O2 and molecular weight 330.06 g/mol. IUPAC: 2-[4-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-3-yl]acetic acid.
Chemical Property Profile of Pirazolac
Property Insights of Pirazolac
The XLogP value of 3.7 indicates that Pirazolac is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, Pirazolac exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pirazolac has 1 hydrogen bond donor(s) and 4 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 Pirazolac?
The CAS number of Pirazolac is 71002-09-0.
What is the molecular formula of Pirazolac?
The molecular formula of Pirazolac is C17H12ClFN2O2.
What is the molecular weight of Pirazolac?
The molecular weight of Pirazolac is 330.06 g/mol.
Where can I buy Pirazolac?
You can request a quote for Pirazolac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pirazolac?
Yes, KEHONG BIO provides custom synthesis services for Pirazolac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.