RefChem:548617
TL;DR: RefChem:548617 (CAS 25743-94-6) is a chemical compound with molecular formula C26H27N3O2 and molecular weight 413.21033 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-(dimethylamino)propylamino]-4-(4-methylanilino)anthracene-9,10-dione
Also Known As: KST-1B2449, 1-(N-(3-Dimethylaminopropyl)amino)-4-(toluidino)anthraquinone, 9,10-Anthracenedione, 1-[[3-(dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]-, 9,10-Anthracenedione, 1-((3-(dimethylamino)propyl)amino)-4-((4-methylphenyl)amino)-, 1-[[3-(DIMETHYLAMINO)PROPYL]AMINO]-4-[(4-METHYLPHENYL)AMINO]ANTHRAQUINONE
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C26H27N3O2 |
| Molecular Weight | 413.21033 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.21033 Da |
| Heavy Atoms | 31 |
| Complexity | 628.0 |
| SMILES | CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NCCCN(C)C)C(=O)C4=CC=CC=C4C3=O |
| InChIKey | FTYQWGDZBXEMPO-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:548617
Property Insights of RefChem:548617
The XLogP value of 6.3 indicates that RefChem:548617 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:548617. Following Lipinski's Rule of Five, RefChem:548617 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:548617?
The CAS number of RefChem:548617 is 25743-94-6.
What is the molecular formula of RefChem:548617?
The molecular formula of RefChem:548617 is C26H27N3O2.
What is the molecular weight of RefChem:548617?
The molecular weight of RefChem:548617 is 413.21033 g/mol.
Where can I buy RefChem:548617?
You can request a quote for RefChem:548617 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:548617?
Yes, CoreyChem provides custom synthesis services for RefChem:548617 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.