替硝唑
TL;DR: 替硝唑 (CAS 19387-91-8) is a chemical compound with molecular formula C8H13N3O4S and molecular weight 247.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
替硝唑
1-(2-ethylsulfonylethyl)-2-methyl-5-nitroimidazole
Also Known As: tinidazole, Tindamax, Fasigyn, Trimonase, Tricolam
| Molecular Formula | C8H13N3O4S |
|---|---|
| Molecular Weight | 247.06 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.06268 |
| Heavy Atoms | 16 |
| Complexity | 345.0 |
| Melting Point | 127-128 °C |
| Solubility | 19900 |
Chemical Identifiers
| CAS Number | 19387-91-8 |
|---|---|
| SMILES | CCS(=O)(=O)CCN1C(=NC=C1[N+](=O)[O-])C |
| InChIKey | HJLSLZFTEKNLFI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
替硝唑 (CAS 19387-91-8), with molecular formula C8H13N3O4S and molecular weight 247.06 g/mol. IUPAC: 1-(2-ethylsulfonylethyl)-2-methyl-5-nitroimidazole.
Chemical Property Profile of 替硝唑
Property Insights of 替硝唑
The XLogP value of -0.4 indicates that 替硝唑 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 替硝唑. Following Lipinski's Rule of Five, 替硝唑 has 0 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 替硝唑?
The CAS number of 替硝唑 is 19387-91-8.
What is the molecular formula of 替硝唑?
The molecular formula of 替硝唑 is C8H13N3O4S.
What is the molecular weight of 替硝唑?
The molecular weight of 替硝唑 is 247.06 g/mol.
Where can I buy 替硝唑?
You can request a quote for 替硝唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 替硝唑?
Yes, KEHONG BIO provides custom synthesis services for 替硝唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.