Aminometradine
TL;DR: Aminometradine (CAS 642-44-4) is a chemical compound with molecular formula C9H13N3O2 and molecular weight 195.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-ethyl-1-prop-2-enylpyrimidine-2,4-dione
Also Known As: AMINOMETRADINE, Mictine, Aminometramide, Catapyrin, Katapyrin
| Molecular Formula | C9H13N3O2 |
|---|---|
| Molecular Weight | 195.10 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.10077 |
| Heavy Atoms | 14 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 642-44-4 |
|---|---|
| SMILES | CCN1C(=O)C=C(N(C1=O)CC=C)N |
| InChIKey | NGXUUAFYUCOICP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aminometradine (CAS 642-44-4), with molecular formula C9H13N3O2 and molecular weight 195.10 g/mol. IUPAC: 6-amino-3-ethyl-1-prop-2-enylpyrimidine-2,4-dione.
Chemical Property Profile of Aminometradine
Property Insights of Aminometradine
The XLogP value of -0.1 indicates that Aminometradine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Aminometradine. Following Lipinski's Rule of Five, Aminometradine has 1 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 Aminometradine?
The CAS number of Aminometradine is 642-44-4.
What is the molecular formula of Aminometradine?
The molecular formula of Aminometradine is C9H13N3O2.
What is the molecular weight of Aminometradine?
The molecular weight of Aminometradine is 195.10 g/mol.
Where can I buy Aminometradine?
You can request a quote for Aminometradine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aminometradine?
Yes, KEHONG BIO provides custom synthesis services for Aminometradine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.