2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-
TL;DR: 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- (CAS 88167-34-4) is a chemical compound with molecular formula C7H5IN2O and molecular weight 259.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-iodo-1-prop-2-ynylpyrimidin-2-one
Also Known As: 1-Propargyl-5-iodopyrimidin-2-one, 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-, 5-Iodo-1-(2-propynyl)-2(1H)-pyrimidinone, 5-iodo-1-prop-2-ynylpyrimidin-2-one, 5-Iodo-1-(prop-2-yn-1-yl)pyrimidin-2(1H)-one
| Molecular Formula | C7H5IN2O |
|---|---|
| Molecular Weight | 259.94 g/mol |
| LogP | 0.4811 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.94467 |
| Heavy Atoms | 11 |
| Complexity | 350.19357 |
Chemical Identifiers
| CAS Number | 88167-34-4 |
|---|---|
| SMILES | C#CCN1C=C(C=NC1=O)I |
Product Overview
2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- (CAS 88167-34-4), with molecular formula C7H5IN2O and molecular weight 259.94 g/mol. IUPAC: 5-iodo-1-prop-2-ynylpyrimidin-2-one.
Chemical Property Profile of 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-
Property Insights of 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-
The XLogP value of 0.4811 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-. With a topological polar surface area (TPSA) of 34.89 Ų, 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- has 0 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 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-?
The CAS number of 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- is 88167-34-4.
What is the molecular formula of 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-?
The molecular formula of 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- is C7H5IN2O.
What is the molecular weight of 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-?
The molecular weight of 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- is 259.94 g/mol.
Where can I buy 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-?
You can request a quote for 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Pyrimidinone, 5-iodo-1-(2-propynyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.