4(1H)-Pyrimidinone, 5-(4-pyridinyl)-
TL;DR: 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- (CAS 2548-44-9) is a chemical compound with molecular formula C9H7N3O and molecular weight 173.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-pyridin-4-yl-1H-pyrimidin-6-one
Also Known As: 5-(4-Pyridinyl)-4(1H)-pyrimidinone, 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-, 5-(pyridin-4-yl)pyrimidin-4(3h)-one, 5-pyridin-4-yl-1H-pyrimidin-6-one, 5-pyridin-4-yl-3H-pyrimidin-4-one
| Molecular Formula | C9H7N3O |
|---|---|
| Molecular Weight | 173.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.05891 |
| Heavy Atoms | 13 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 2548-44-9 |
|---|---|
| SMILES | C1=CN=CC=C1C2=CN=CNC2=O |
| InChIKey | MZDSAQFMGVWPIS-UHFFFAOYSA-N |
Product Overview
4(1H)-Pyrimidinone, 5-(4-pyridinyl)- (CAS 2548-44-9), with molecular formula C9H7N3O and molecular weight 173.06 g/mol. IUPAC: 5-pyridin-4-yl-1H-pyrimidin-6-one.
Chemical Property Profile of 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-
Property Insights of 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-
The XLogP value of -0.1 indicates that 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.4 Ų, 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- has 1 hydrogen bond donor(s) and 3 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 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-?
The CAS number of 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- is 2548-44-9.
What is the molecular formula of 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-?
The molecular formula of 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- is C9H7N3O.
What is the molecular weight of 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-?
The molecular weight of 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- is 173.06 g/mol.
Where can I buy 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-?
You can request a quote for 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(1H)-Pyrimidinone, 5-(4-pyridinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4(1H)-Pyrimidinone, 5-(4-pyridinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.