1,4-Bis((3-hydroxypropyl)amino)anthraquinone
TL;DR: 1,4-Bis((3-hydroxypropyl)amino)anthraquinone (CAS 67701-36-4) is a chemical compound with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(3-hydroxypropylamino)anthracene-9,10-dione
Also Known As: 1,4-Bis((3-hydroxypropyl)amino)anthraquinone, 9,10-Anthracenedione, 1,4-bis[(3-hydroxypropyl)amino]-, 1,4-Bis((3-hydroxypropyl)amino)-9,10-anthracenedione, 1,4-Bis(3-hydroxypropylamino)-9,10-anthracenedione, 1,4-BIS[(3-HYDROXYPROPYL)AMINO]ANTHRAQUINONE
| Molecular Formula | C20H22N2O4 |
|---|---|
| Molecular Weight | 354.16 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 354.15796 |
| Heavy Atoms | 26 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 67701-36-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCCO)NCCCO |
| InChIKey | LUYYUZYWBTWOFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Bis((3-hydroxypropyl)amino)anthraquinone (CAS 67701-36-4), with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol. IUPAC: 1,4-bis(3-hydroxypropylamino)anthracene-9,10-dione.
Chemical Property Profile of 1,4-Bis((3-hydroxypropyl)amino)anthraquinone
Property Insights of 1,4-Bis((3-hydroxypropyl)amino)anthraquinone
The XLogP value of 3.3 indicates that 1,4-Bis((3-hydroxypropyl)amino)anthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis((3-hydroxypropyl)amino)anthraquinone. Following Lipinski's Rule of Five, 1,4-Bis((3-hydroxypropyl)amino)anthraquinone has 4 hydrogen bond donor(s) and 6 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 1,4-Bis((3-hydroxypropyl)amino)anthraquinone?
The CAS number of 1,4-Bis((3-hydroxypropyl)amino)anthraquinone is 67701-36-4.
What is the molecular formula of 1,4-Bis((3-hydroxypropyl)amino)anthraquinone?
The molecular formula of 1,4-Bis((3-hydroxypropyl)amino)anthraquinone is C20H22N2O4.
What is the molecular weight of 1,4-Bis((3-hydroxypropyl)amino)anthraquinone?
The molecular weight of 1,4-Bis((3-hydroxypropyl)amino)anthraquinone is 354.16 g/mol.
Where can I buy 1,4-Bis((3-hydroxypropyl)amino)anthraquinone?
You can request a quote for 1,4-Bis((3-hydroxypropyl)amino)anthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis((3-hydroxypropyl)amino)anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis((3-hydroxypropyl)amino)anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.