5-Iodouracil
TL;DR: 5-Iodouracil (CAS 696-07-1) is a chemical compound with molecular formula C4H3IN2O2 and molecular weight 237.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-iodo-1H-pyrimidine-2,4-dione
Also Known As: 5-Iodouracil, Uracil, 5-iodo-, 5-iodopyrimidine-2,4(1H,3H)-dione, 5-iodo-1H-pyrimidine-2,4-dione, 5-Iodo-uracil
| Molecular Formula | C4H3IN2O2 |
|---|---|
| Molecular Weight | 237.92 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 237.92392 |
| Heavy Atoms | 9 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 696-07-1 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1)I |
| InChIKey | KSNXJLQDQOIRIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Iodouracil (CAS 696-07-1), with molecular formula C4H3IN2O2 and molecular weight 237.92 g/mol. IUPAC: 5-iodo-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-Iodouracil
Property Insights of 5-Iodouracil
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Iodouracil. With a topological polar surface area (TPSA) of 58.2 Ų, 5-Iodouracil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Iodouracil has 2 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-Iodouracil?
The CAS number of 5-Iodouracil is 696-07-1.
What is the molecular formula of 5-Iodouracil?
The molecular formula of 5-Iodouracil is C4H3IN2O2.
What is the molecular weight of 5-Iodouracil?
The molecular weight of 5-Iodouracil is 237.92 g/mol.
Where can I buy 5-Iodouracil?
You can request a quote for 5-Iodouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Iodouracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Iodouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.