Melitracen Hydrochloride
TL;DR: Melitracen Hydrochloride (CAS 10563-70-9) is a chemical compound with molecular formula C21H26ClN and molecular weight 327.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(10,10-dimethylanthracen-9-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride
Also Known As: MELITRACEN HYDROCHLORIDE, Melitracen HCl, Thymeol hydrochloride, Melitracene hydrochloride, Melitracen
| Molecular Formula | C21H26ClN |
|---|---|
| Molecular Weight | 327.18 g/mol |
| LogP | 5.13 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.17538 |
| Heavy Atoms | 23 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 10563-70-9 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2C(=CCCN(C)C)C3=CC=CC=C31)C.Cl |
| InChIKey | RADLXCPDUXFGFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Melitracen Hydrochloride (CAS 10563-70-9), with molecular formula C21H26ClN and molecular weight 327.18 g/mol. IUPAC: 3-(10,10-dimethylanthracen-9-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride.
Chemical Property Profile of Melitracen Hydrochloride
Property Insights of Melitracen Hydrochloride
The XLogP value of 5.13 indicates that Melitracen Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Melitracen Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Melitracen Hydrochloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Melitracen Hydrochloride?
The CAS number of Melitracen Hydrochloride is 10563-70-9.
What is the molecular formula of Melitracen Hydrochloride?
The molecular formula of Melitracen Hydrochloride is C21H26ClN.
What is the molecular weight of Melitracen Hydrochloride?
The molecular weight of Melitracen Hydrochloride is 327.18 g/mol.
Where can I buy Melitracen Hydrochloride?
You can request a quote for Melitracen Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Melitracen Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Melitracen Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.