Nitramisole Hydrochloride
TL;DR: Nitramisole Hydrochloride (CAS 56689-44-2) is a chemical compound with molecular formula C11H12ClN3O2S and molecular weight 285.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-nitrophenyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;hydrochloride
Also Known As: Nitramisole HCl, Nitramisole hydrochloride, Nitramisole hydrochloride [USAN], Nitramisole hydrochloride (USAN), R 29,860
| Molecular Formula | C11H12ClN3O2S |
|---|---|
| Molecular Weight | 285.03 g/mol |
| LogP | 2.4761 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.03387 |
| Heavy Atoms | 18 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 56689-44-2 |
|---|---|
| SMILES | C1CSC2=NC(CN21)C3=CC(=CC=C3)[N+](=O)[O-].Cl |
| InChIKey | ILUWATRNRIWZJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nitramisole Hydrochloride (CAS 56689-44-2), with molecular formula C11H12ClN3O2S and molecular weight 285.03 g/mol. IUPAC: 6-(3-nitrophenyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;hydrochloride.
Chemical Property Profile of Nitramisole Hydrochloride
Property Insights of Nitramisole Hydrochloride
The XLogP value of 2.4761 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitramisole Hydrochloride. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitramisole Hydrochloride. Following Lipinski's Rule of Five, Nitramisole Hydrochloride has 1 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 Nitramisole Hydrochloride?
The CAS number of Nitramisole Hydrochloride is 56689-44-2.
What is the molecular formula of Nitramisole Hydrochloride?
The molecular formula of Nitramisole Hydrochloride is C11H12ClN3O2S.
What is the molecular weight of Nitramisole Hydrochloride?
The molecular weight of Nitramisole Hydrochloride is 285.03 g/mol.
Where can I buy Nitramisole Hydrochloride?
You can request a quote for Nitramisole Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitramisole Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Nitramisole Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.