安替比林
TL;DR: 安替比林 (CAS 60-80-0) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
安替比林
1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: antipyrine, Phenazone, Analgesine, Antipyrin, Anodynine
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 266.0 |
| Melting Point | 114 |
| Boiling Point | 319 |
| Density | Relative density (water = 1): 1.19 |
| Solubility | 51900 |
Chemical Identifiers
| CAS Number | 60-80-0 |
|---|---|
| SMILES | CC1=CC(=O)N(N1C)C2=CC=CC=C2 |
| InChIKey | VEQOALNAAJBPNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
安替比林 (CAS 60-80-0), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of 安替比林
Property Insights of 安替比林
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 安替比林. With a topological polar surface area (TPSA) of 23.6 Ų, 安替比林 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 安替比林 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 安替比林?
The CAS number of 安替比林 is 60-80-0.
What is the molecular formula of 安替比林?
The molecular formula of 安替比林 is C11H12N2O.
What is the molecular weight of 安替比林?
The molecular weight of 安替比林 is 188.09 g/mol.
Where can I buy 安替比林?
You can request a quote for 安替比林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 安替比林?
Yes, KEHONG BIO provides custom synthesis services for 安替比林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.