9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-
TL;DR: 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- (CAS 68227-28-1) is a chemical compound with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(butylamino)-4-(methylamino)anthracene-9,10-dione
Also Known As: 1-(Butylamino)-4-(methylamino)anthraquinone, 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-, 1-(butylamino)-4-(methylamino)-9,10-anthraquinone, 1-(butylamino)-4-(methylamino)anthracene-9,10-dione, 1-(n-Butylamino)-4-methylamino-9,10-anthracenedione
| Molecular Formula | C19H20N2O2 |
|---|---|
| Molecular Weight | 308.15 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.15247 |
| Heavy Atoms | 23 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 68227-28-1 |
|---|---|
| SMILES | CCCCNC1=C2C(=C(C=C1)NC)C(=O)C3=CC=CC=C3C2=O |
| InChIKey | KWKQLGSQUUYRDV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- (CAS 68227-28-1), with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol. IUPAC: 1-(butylamino)-4-(methylamino)anthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-
Property Insights of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-
The XLogP value of 5.2 indicates that 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-?
The CAS number of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- is 68227-28-1.
What is the molecular formula of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-?
The molecular formula of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- is C19H20N2O2.
What is the molecular weight of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-?
The molecular weight of 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- is 308.15 g/mol.
Where can I buy 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-?
You can request a quote for 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1-(butylamino)-4-(methylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.