5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil
TL;DR: 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil (CAS 121749-87-9) is a chemical compound with molecular formula C7H8BrIN2O4 and molecular weight 389.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-(2-hydroxyethoxymethyl)-6-iodopyrimidine-2,4-dione
Also Known As: 5-Br-HEIU, 6-I-5-BrU-analog, 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil, 5-Bromo-1-[(2-hydroxyethoxy)methyl]-6-iodo-uracil, 5-bromo-1-(2-hydroxyethoxymethyl)-6-iodopyrimidine-2,4-dione
| Molecular Formula | C7H8BrIN2O4 |
|---|---|
| Molecular Weight | 389.87 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.87122 |
| Heavy Atoms | 15 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 121749-87-9 |
|---|---|
| SMILES | C(COCN1C(=C(C(=O)NC1=O)Br)I)O |
| InChIKey | YAWJAJCLFDAVNE-UHFFFAOYSA-N |
Product Overview
5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil (CAS 121749-87-9), with molecular formula C7H8BrIN2O4 and molecular weight 389.87 g/mol. IUPAC: 5-bromo-1-(2-hydroxyethoxymethyl)-6-iodopyrimidine-2,4-dione.
Chemical Property Profile of 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil
Property Insights of 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil. Following Lipinski's Rule of Five, 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil has 2 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 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil?
The CAS number of 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil is 121749-87-9.
What is the molecular formula of 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil?
The molecular formula of 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil is C7H8BrIN2O4.
What is the molecular weight of 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil?
The molecular weight of 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil is 389.87 g/mol.
Where can I buy 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil?
You can request a quote for 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.