Dimetacrine
TL;DR: Dimetacrine (CAS 4757-55-5) is a chemical compound with molecular formula C20H26N2 and molecular weight 294.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(9,9-dimethylacridin-10-yl)-N,N-dimethylpropan-1-amine
Also Known As: Dimetacrine, Dimethacrine, Dimethacrin, Dimetacrinum, Dimetacrino
| Molecular Formula | C20H26N2 |
|---|---|
| Molecular Weight | 294.21 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.2096 |
| Heavy Atoms | 22 |
| Complexity | 337.0 |
| Melting Point | 155-156 |
Chemical Identifiers
| CAS Number | 4757-55-5 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2N(C3=CC=CC=C31)CCCN(C)C)C |
| InChIKey | RYQOGSFEJBUZBX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimetacrine (CAS 4757-55-5), with molecular formula C20H26N2 and molecular weight 294.21 g/mol. IUPAC: 3-(9,9-dimethylacridin-10-yl)-N,N-dimethylpropan-1-amine.
Chemical Property Profile of Dimetacrine
Property Insights of Dimetacrine
The XLogP value of 5.4 indicates that Dimetacrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Dimetacrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimetacrine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimetacrine?
The CAS number of Dimetacrine is 4757-55-5.
What is the molecular formula of Dimetacrine?
The molecular formula of Dimetacrine is C20H26N2.
What is the molecular weight of Dimetacrine?
The molecular weight of Dimetacrine is 294.21 g/mol.
Where can I buy Dimetacrine?
You can request a quote for Dimetacrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimetacrine?
Yes, KEHONG BIO provides custom synthesis services for Dimetacrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.