RefChem:117607
TL;DR: RefChem:117607 (CAS 70210-03-6) is a chemical compound with molecular formula C24H24ClN3O2 and molecular weight 421.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(4-amino-9,10-dioxoanthracen-1-yl)amino]phenyl]methyl-trimethylazanium chloride
Also Known As: [p-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthryl)amino]benzyl]trimethylammonium chloride|{4-[(4-amino-9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]phenyl}-n,n,n-trimethylmethanaminium chloride|Benzenemethanaminium, 4-((4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-N,N,N-trimethyl-, chloride|Benzenemethanaminium, 4-((4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-N,N,N-trimethyl-, chloride (1:1)|(p-((4-Amino-9,10-dihydro-9,10-dioxo-1-anthryl)amino)benzyl)trimethylammonium chloride|Benzenemethanaminium, 4-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-N,N,N-trimethyl-, chloride|Benzenemethanaminium, 4-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-N,N,N-trimethyl-, chloride (1:1)|[4-[(4-amino-9,10-dioxoanthracen-1-yl)amino]phenyl]methyl-trimethylazanium chloride|EINECS 274-400-0|RefChem:117607|DTXCID601026829
| Molecular Formula | C24H24ClN3O2 |
|---|---|
| Molecular Weight | 421.16 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.1557 |
| Heavy Atoms | 30 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 70210-03-6 |
|---|---|
| SMILES | C[N+](C)(C)CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O.[Cl-] |
| InChIKey | YWQGBEZVKSQFGW-UHFFFAOYSA-N |
Product Overview
RefChem:117607 (CAS 70210-03-6), with molecular formula C24H24ClN3O2 and molecular weight 421.16 g/mol. IUPAC: [4-[(4-amino-9,10-dioxoanthracen-1-yl)amino]phenyl]methyl-trimethylazanium chloride.
Chemical Property Profile of RefChem:117607
Property Insights of RefChem:117607
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:117607. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:117607. Following Lipinski's Rule of Five, RefChem:117607 has 2 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:117607?
The CAS number of RefChem:117607 is 70210-03-6.
What is the molecular formula of RefChem:117607?
The molecular formula of RefChem:117607 is C24H24ClN3O2.
What is the molecular weight of RefChem:117607?
The molecular weight of RefChem:117607 is 421.16 g/mol.
Where can I buy RefChem:117607?
You can request a quote for RefChem:117607 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:117607?
Yes, KEHONG BIO provides custom synthesis services for RefChem:117607 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.