甲硝唑磷酸酯
TL;DR: 甲硝唑磷酸酯 (CAS 73334-05-1) is a chemical compound with molecular formula C6H10N3O6P and molecular weight 251.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲硝唑磷酸酯
2-(2-methyl-5-nitroimidazol-1-yl)ethyl dihydrogen phosphate
Also Known As: METRONIDAZOLE PHOSPHATE, 2- ethoxyphosphonicacid, Metronidazole Phosphoester, Metronidazole phosphate [USAN], Metronidazole Impurity 38
| Molecular Formula | C6H10N3O6P |
|---|---|
| Molecular Weight | 251.03 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.03072 |
| Heavy Atoms | 16 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 73334-05-1 |
|---|---|
| SMILES | CC1=NC=C(N1CCOP(=O)(O)O)[N+](=O)[O-] |
| InChIKey | GFFOAZOYBIIJHI-UHFFFAOYSA-N |
Product Overview
甲硝唑磷酸酯 (CAS 73334-05-1), with molecular formula C6H10N3O6P and molecular weight 251.03 g/mol. IUPAC: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl dihydrogen phosphate.
Chemical Property Profile of 甲硝唑磷酸酯
Property Insights of 甲硝唑磷酸酯
The XLogP value of -1.5 indicates that 甲硝唑磷酸酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 甲硝唑磷酸酯. Following Lipinski's Rule of Five, 甲硝唑磷酸酯 has 2 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 甲硝唑磷酸酯?
The CAS number of 甲硝唑磷酸酯 is 73334-05-1.
What is the molecular formula of 甲硝唑磷酸酯?
The molecular formula of 甲硝唑磷酸酯 is C6H10N3O6P.
What is the molecular weight of 甲硝唑磷酸酯?
The molecular weight of 甲硝唑磷酸酯 is 251.03 g/mol.
Where can I buy 甲硝唑磷酸酯?
You can request a quote for 甲硝唑磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲硝唑磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 甲硝唑磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.