RefChem:107467
TL;DR: RefChem:107467 (CAS 67905-56-0) is a chemical compound with molecular formula C23H22ClN3O2 and molecular weight 407.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-[4-[(dimethylamino)methyl]anilino]anthracene-9,10-dione;hydrochloride
Also Known As: 1-Amino-4-((4-((dimethylamino)methyl)phenyl)amino)anthraquinone monohydrochloride, 9,10-Anthracenedione, 1-amino-4-[[4-[(dimethylamino)methyl]phenyl]amino]-, monohydrochloride, 1-Amino-4-(4-(alpha-(dimethylammonium)methyl)phenyl)aminoanthraquinone, chloride, 1-amino-4-[4-[(dimethylamino)methyl]anilino]anthracene-9,10-dione;hydrochloride, 9,10-Anthracenedione, 1-amino-4-((4-((dimethylamino)methyl)phenyl)amino)-, monohydrochloride
| Molecular Formula | C23H22ClN3O2 |
|---|---|
| Molecular Weight | 407.14 g/mol |
| LogP | 4.27 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.14005 |
| Heavy Atoms | 29 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 67905-56-0 |
|---|---|
| SMILES | CN(C)CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O.Cl |
| InChIKey | JPJZNMUFYKRLGZ-UHFFFAOYSA-N |
Product Overview
RefChem:107467 (CAS 67905-56-0), with molecular formula C23H22ClN3O2 and molecular weight 407.14 g/mol. IUPAC: 1-amino-4-[4-[(dimethylamino)methyl]anilino]anthracene-9,10-dione;hydrochloride.
Chemical Property Profile of RefChem:107467
Property Insights of RefChem:107467
The XLogP value of 4.27 indicates that RefChem:107467 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:107467. Following Lipinski's Rule of Five, RefChem:107467 has 3 hydrogen bond donor(s) and 5 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 RefChem:107467?
The CAS number of RefChem:107467 is 67905-56-0.
What is the molecular formula of RefChem:107467?
The molecular formula of RefChem:107467 is C23H22ClN3O2.
What is the molecular weight of RefChem:107467?
The molecular weight of RefChem:107467 is 407.14 g/mol.
Where can I buy RefChem:107467?
You can request a quote for RefChem:107467 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:107467?
Yes, KEHONG BIO provides custom synthesis services for RefChem:107467 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.