4-Aminoantipyrine hydrochloride
TL;DR: 4-Aminoantipyrine hydrochloride (CAS 22198-72-7) is a chemical compound with molecular formula C11H14ClN3O and molecular weight 239.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1,5-dimethyl-2-phenylpyrazol-3-one;hydrochloride
Also Known As: 4-Aminoantipyrine hydrochloride, Ampyrone hydrochloride, Pentanochlor, 4-Amino-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one hydrochloride, 4-AMINOANTIPYRINE HCl
| Molecular Formula | C11H14ClN3O |
|---|---|
| Molecular Weight | 239.08 g/mol |
| LogP | 1.49 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.08253 |
| Heavy Atoms | 16 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 22198-72-7 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N.Cl |
| InChIKey | UZSCVCWALGRUTR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Aminoantipyrine hydrochloride (CAS 22198-72-7), with molecular formula C11H14ClN3O and molecular weight 239.08 g/mol. IUPAC: 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one;hydrochloride.
Chemical Property Profile of 4-Aminoantipyrine hydrochloride
Property Insights of 4-Aminoantipyrine hydrochloride
The XLogP value of 1.49 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminoantipyrine hydrochloride. With a topological polar surface area (TPSA) of 49.6 Ų, 4-Aminoantipyrine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Aminoantipyrine hydrochloride has 2 hydrogen bond donor(s) and 3 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 4-Aminoantipyrine hydrochloride?
The CAS number of 4-Aminoantipyrine hydrochloride is 22198-72-7.
What is the molecular formula of 4-Aminoantipyrine hydrochloride?
The molecular formula of 4-Aminoantipyrine hydrochloride is C11H14ClN3O.
What is the molecular weight of 4-Aminoantipyrine hydrochloride?
The molecular weight of 4-Aminoantipyrine hydrochloride is 239.08 g/mol.
Where can I buy 4-Aminoantipyrine hydrochloride?
You can request a quote for 4-Aminoantipyrine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Aminoantipyrine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Aminoantipyrine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.