2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-
TL;DR: 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)- (CAS 63331-27-1) is a chemical compound with molecular formula C7H5FN2O and molecular weight 152.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-1-prop-2-ynylpyrimidin-2-one
Also Known As: 1-Propargyl-5-fluoropyrimidin-2-one, 5-Fluoro-1-(2-propynyl)-2(1H)-pyrimidinone, 5-fluoro-1-prop-2-ynylpyrimidin-2-one, 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-, 5-24-02-00064 (Beilstein Handbook Reference)
| Molecular Formula | C7H5FN2O |
|---|---|
| Molecular Weight | 152.04 g/mol |
| LogP | 0.0156 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.03859 |
| Heavy Atoms | 11 |
| Complexity | 350.19357 |
Chemical Identifiers
| CAS Number | 63331-27-1 |
|---|---|
| SMILES | C#CCN1C=C(C=NC1=O)F |
Product Overview
2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)- (CAS 63331-27-1), with molecular formula C7H5FN2O and molecular weight 152.04 g/mol. IUPAC: 5-fluoro-1-prop-2-ynylpyrimidin-2-one.
Chemical Property Profile of 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-
Property Insights of 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-
The XLogP value of 0.0156 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-. With a topological polar surface area (TPSA) of 34.89 Ų, 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Pyrimidinone, 5-fluoro-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-fluoro-1-(2-propynyl)-?
The CAS number of 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)- is 63331-27-1.
What is the molecular formula of 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-?
The molecular formula of 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)- is C7H5FN2O.
What is the molecular weight of 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-?
The molecular weight of 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)- is 152.04 g/mol.
Where can I buy 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)-?
You can request a quote for 2(1H)-Pyrimidinone, 5-fluoro-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-fluoro-1-(2-propynyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Pyrimidinone, 5-fluoro-1-(2-propynyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.