3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol
TL;DR: 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol (CAS 21431-57-2) is a chemical compound with molecular formula C7H10BrN3O4 and molecular weight 278.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-bromo-2-methyl-4-nitroimidazol-1-yl)propane-1,2-diol
Also Known As: 3-(5-bromo-2-methyl-4-nitroimidazol-1-yl)propane-1,2-diol, 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol, 3-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)propane-1,2-diol
| Molecular Formula | C7H10BrN3O4 |
|---|---|
| Molecular Weight | 278.99 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.98547 |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 21431-57-2 |
|---|---|
| SMILES | CC1=NC(=C(N1CC(CO)O)Br)[N+](=O)[O-] |
| InChIKey | NYTPKMBEGZQHAF-UHFFFAOYSA-N |
Product Overview
3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol (CAS 21431-57-2), with molecular formula C7H10BrN3O4 and molecular weight 278.99 g/mol. IUPAC: 3-(5-bromo-2-methyl-4-nitroimidazol-1-yl)propane-1,2-diol.
Chemical Property Profile of 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol
Property Insights of 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol
The XLogP value of -0.9 indicates that 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol. Following Lipinski's Rule of Five, 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol has 2 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 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol?
The CAS number of 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol is 21431-57-2.
What is the molecular formula of 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol?
The molecular formula of 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol is C7H10BrN3O4.
What is the molecular weight of 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol?
The molecular weight of 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol is 278.99 g/mol.
Where can I buy 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol?
You can request a quote for 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Bromo-2-methyl-4-nitro-1H-imidazol-1-yl)propane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.