5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
TL;DR: 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione (CAS 45774-47-8) is a chemical compound with molecular formula C5H5IN2O2 and molecular weight 251.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-iodo-1-methylpyrimidine-2,4-dione
Also Known As: 5-iodo-1-methyluracil, 1-Methyl-5-iodouracil, 1-Methyl-5-joduracil, 5-iodo-1-methylpyrimidine-2,4-dione, 5-Iodo-1-methylpyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C5H5IN2O2 |
|---|---|
| Molecular Weight | 251.94 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.93958 |
| Heavy Atoms | 10 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 45774-47-8 |
|---|---|
| SMILES | CN1C=C(C(=O)NC1=O)I |
| InChIKey | VQCQTJWSCCBUFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione (CAS 45774-47-8), with molecular formula C5H5IN2O2 and molecular weight 251.94 g/mol. IUPAC: 5-iodo-1-methylpyrimidine-2,4-dione.
Chemical Property Profile of 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Property Insights of 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
The XLogP value of -0.1 indicates that 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.4 Ų, 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione has 1 hydrogen bond donor(s) and 2 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-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The CAS number of 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione is 45774-47-8.
What is the molecular formula of 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The molecular formula of 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione is C5H5IN2O2.
What is the molecular weight of 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The molecular weight of 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione is 251.94 g/mol.
Where can I buy 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
You can request a quote for 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Iodo-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.