Desoxyoxamniquine
TL;DR: Desoxyoxamniquine (CAS 5438-29-9) is a chemical compound with molecular formula C14H21N3O2 and molecular weight 263.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]propan-2-amine
Also Known As: Desoxymansil, Desoxyoxamniquine, UK 3883, 2-Isopropylaminomethyl-6-methyl-7-nitro-1,2,3,4-tetrahydroquinoline, N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]propan-2-amine
| Molecular Formula | C14H21N3O2 |
|---|---|
| Molecular Weight | 263.16 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.1634 |
| Heavy Atoms | 19 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 5438-29-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1[N+](=O)[O-])NC(CC2)CNC(C)C |
| InChIKey | XRDXINBBVUAHGQ-UHFFFAOYSA-N |
Product Overview
Desoxyoxamniquine (CAS 5438-29-9), with molecular formula C14H21N3O2 and molecular weight 263.16 g/mol. IUPAC: N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]propan-2-amine.
Chemical Property Profile of Desoxyoxamniquine
Property Insights of Desoxyoxamniquine
The XLogP value of 3.5 indicates that Desoxyoxamniquine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Desoxyoxamniquine. Following Lipinski's Rule of Five, Desoxyoxamniquine has 2 hydrogen bond donor(s) and 4 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 Desoxyoxamniquine?
The CAS number of Desoxyoxamniquine is 5438-29-9.
What is the molecular formula of Desoxyoxamniquine?
The molecular formula of Desoxyoxamniquine is C14H21N3O2.
What is the molecular weight of Desoxyoxamniquine?
The molecular weight of Desoxyoxamniquine is 263.16 g/mol.
Where can I buy Desoxyoxamniquine?
You can request a quote for Desoxyoxamniquine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desoxyoxamniquine?
Yes, KEHONG BIO provides custom synthesis services for Desoxyoxamniquine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.