Nitracrine
TL;DR: Nitracrine (CAS 4533-39-5) is a chemical compound with molecular formula C18H20N4O2 and molecular weight 324.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N',N'-dimethyl-N-(1-nitroacridin-9-yl)propane-1,3-diamine
Also Known As: Nitracrine, Nitracrina, Nitracrinum, Ledakrin, Ledacrine
| Molecular Formula | C18H20N4O2 |
|---|---|
| Molecular Weight | 324.16 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.15863 |
| Heavy Atoms | 24 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 4533-39-5 |
|---|---|
| SMILES | CN(C)CCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-] |
| InChIKey | YMVWGSQGCWCDGW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nitracrine (CAS 4533-39-5), with molecular formula C18H20N4O2 and molecular weight 324.16 g/mol. IUPAC: N',N'-dimethyl-N-(1-nitroacridin-9-yl)propane-1,3-diamine.
Chemical Property Profile of Nitracrine
Property Insights of Nitracrine
The XLogP value of 3.7 indicates that Nitracrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitracrine. Following Lipinski's Rule of Five, Nitracrine has 1 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 Nitracrine?
The CAS number of Nitracrine is 4533-39-5.
What is the molecular formula of Nitracrine?
The molecular formula of Nitracrine is C18H20N4O2.
What is the molecular weight of Nitracrine?
The molecular weight of Nitracrine is 324.16 g/mol.
Where can I buy Nitracrine?
You can request a quote for Nitracrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitracrine?
Yes, KEHONG BIO provides custom synthesis services for Nitracrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.