Doranidazole
TL;DR: Doranidazole (CAS 137339-64-1) is a chemical compound with molecular formula C8H13N3O6 and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S)-3-[(2-nitroimidazol-1-yl)methoxy]butane-1,2,4-triol
Also Known As: Doranidazole, doranidazolum, Doranidazol, Doranidazole [INN], SynaptoGreen? C4
| Molecular Formula | C8H13N3O6 |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 247.08043 |
| Heavy Atoms | 17 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 137339-64-1 |
|---|---|
| SMILES | C1=CN(C(=N1)[N+](=O)[O-])CO[C@@H](CO)[C@@H](CO)O |
| InChIKey | FIITXXIVUIXYMI-RQJHMYQMSA-N |
Product Overview
Doranidazole (CAS 137339-64-1), with molecular formula C8H13N3O6 and molecular weight 247.08 g/mol. IUPAC: (2R,3S)-3-[(2-nitroimidazol-1-yl)methoxy]butane-1,2,4-triol.
Chemical Property Profile of Doranidazole
Property Insights of Doranidazole
The XLogP value of -1.8 indicates that Doranidazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Doranidazole. Following Lipinski's Rule of Five, Doranidazole has 3 hydrogen bond donor(s) and 7 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 Doranidazole?
The CAS number of Doranidazole is 137339-64-1.
What is the molecular formula of Doranidazole?
The molecular formula of Doranidazole is C8H13N3O6.
What is the molecular weight of Doranidazole?
The molecular weight of Doranidazole is 247.08 g/mol.
Where can I buy Doranidazole?
You can request a quote for Doranidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Doranidazole?
Yes, KEHONG BIO provides custom synthesis services for Doranidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.