CTK4E3188
TL;DR: CTK4E3188 (CAS 20064-01-1) is a chemical compound with molecular formula C19H24Cl2N4O3 and molecular weight 426.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-[(1-nitroacridin-9-yl)amino]butan-1-amine oxide;dihydrochloride
Also Known As: C 619, 1,4-Butanediamine, N,N-dimethyl-N'-(1-nitro-9-acridinyl)-, N-oxide, dihydrochloride, n-[4-(dimethylnitroryl)butyl]-1-nitroacridin-9-amine dihydrochloride, N,N-dimethyl-4-[(1-nitroacridin-9-yl)amino]butan-1-amine Oxide Dihydrochloride, DIMETHYL-[4-[(1-NITROACRIDIN-9-YL)AMINO]BUTYL]-OXIDO-AZANIUM DIHYDROCH LORIDE
| Molecular Formula | C19H24Cl2N4O3 |
|---|---|
| Molecular Weight | 426.12 g/mol |
| LogP | 4.91 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.12256 |
| Heavy Atoms | 28 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 20064-01-1 |
|---|---|
| SMILES | C[N+](C)(CCCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-])[O-].Cl.Cl |
| InChIKey | VYGGHOUMHUPBSU-UHFFFAOYSA-N |
Product Overview
CTK4E3188 (CAS 20064-01-1), with molecular formula C19H24Cl2N4O3 and molecular weight 426.12 g/mol. IUPAC: N,N-dimethyl-4-[(1-nitroacridin-9-yl)amino]butan-1-amine oxide;dihydrochloride.
Chemical Property Profile of CTK4E3188
Property Insights of CTK4E3188
The XLogP value of 4.91 indicates that CTK4E3188 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4E3188. Following Lipinski's Rule of Five, CTK4E3188 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 CTK4E3188?
The CAS number of CTK4E3188 is 20064-01-1.
What is the molecular formula of CTK4E3188?
The molecular formula of CTK4E3188 is C19H24Cl2N4O3.
What is the molecular weight of CTK4E3188?
The molecular weight of CTK4E3188 is 426.12 g/mol.
Where can I buy CTK4E3188?
You can request a quote for CTK4E3188 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4E3188?
Yes, KEHONG BIO provides custom synthesis services for CTK4E3188 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.