Ternidazole
TL;DR: Ternidazole (CAS 1077-93-6) is a chemical compound with molecular formula C7H11N3O3 and molecular weight 185.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methyl-5-nitroimidazol-1-yl)propan-1-ol
Also Known As: Ternidazole, Ternidazol, Ternidazolum, ternidazole[inn], Ternidazole [INN]
| Molecular Formula | C7H11N3O3 |
|---|---|
| Molecular Weight | 185.08 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.08005 |
| Heavy Atoms | 13 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 1077-93-6 |
|---|---|
| SMILES | CC1=NC=C(N1CCCO)[N+](=O)[O-] |
| InChIKey | DUOHVNSMLSPTMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ternidazole (CAS 1077-93-6), with molecular formula C7H11N3O3 and molecular weight 185.08 g/mol. IUPAC: 3-(2-methyl-5-nitroimidazol-1-yl)propan-1-ol.
Chemical Property Profile of Ternidazole
Property Insights of Ternidazole
The XLogP value of -1.1 indicates that Ternidazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ternidazole. Following Lipinski's Rule of Five, Ternidazole 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 Ternidazole?
The CAS number of Ternidazole is 1077-93-6.
What is the molecular formula of Ternidazole?
The molecular formula of Ternidazole is C7H11N3O3.
What is the molecular weight of Ternidazole?
The molecular weight of Ternidazole is 185.08 g/mol.
Where can I buy Ternidazole?
You can request a quote for Ternidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ternidazole?
Yes, KEHONG BIO provides custom synthesis services for Ternidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.