9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-
TL;DR: 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- (CAS 29311-94-2) is a chemical compound with molecular formula C20H20Cl2N2O4 and molecular weight 422.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis[(3-chloro-2-hydroxypropyl)amino]anthracene-9,10-dione
Also Known As: 1,4-Bis((3-chloro-2-hydroxypropyl)amino)anthraquinone, 9,10-Anthracenedione, 1,4-bis[(3-chloro-2-hydroxypropyl)amino]-, 1,4-Bis((3-chloro-2-hydroxypropyl)amino)-9,10-anthracenedione, 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-, 1,4-bis[(3-chloro-2-hydroxypropyl)amino]-9,10-anthracenedione
| Molecular Formula | C20H20Cl2N2O4 |
|---|---|
| Molecular Weight | 422.08 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 422.08002 |
| Heavy Atoms | 28 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 29311-94-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCC(CCl)O)NCC(CCl)O |
| InChIKey | SYZOCKFTUCTLFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- (CAS 29311-94-2), with molecular formula C20H20Cl2N2O4 and molecular weight 422.08 g/mol. IUPAC: 1,4-bis[(3-chloro-2-hydroxypropyl)amino]anthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-
Property Insights of 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-
The XLogP value of 3.9 indicates that 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- 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 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- 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 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-?
The CAS number of 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- is 29311-94-2.
What is the molecular formula of 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-?
The molecular formula of 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- is C20H20Cl2N2O4.
What is the molecular weight of 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-?
The molecular weight of 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- is 422.08 g/mol.
Where can I buy 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-?
You can request a quote for 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- 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, 1,4-bis((3-chloro-2-hydroxypropyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1,4-bis((3-chloro-2-hydroxypropyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.