2(1H)-Pyrimidinone, 1-methyl-
TL;DR: 2(1H)-Pyrimidinone, 1-methyl- (CAS 3739-81-9) is a chemical compound with molecular formula C5H6N2O and molecular weight 110.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylpyrimidin-2-one
Also Known As: 1-Methylpyrimidin-2(1H)-one, 1-methylpyrimidin-2-one, 1-methyl-2-pyrimidone, 1-Methyl-1H-pyrimidin-2-one, 1-methyl-2-pyrimidinone
| Molecular Formula | C5H6N2O |
|---|---|
| Molecular Weight | 110.05 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.04801 |
| Heavy Atoms | 8 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 3739-81-9 |
|---|---|
| SMILES | CN1C=CC=NC1=O |
| InChIKey | LQKMCBPMBNUKSU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2(1H)-Pyrimidinone, 1-methyl- (CAS 3739-81-9), with molecular formula C5H6N2O and molecular weight 110.05 g/mol. IUPAC: 1-methylpyrimidin-2-one.
Chemical Property Profile of 2(1H)-Pyrimidinone, 1-methyl-
Property Insights of 2(1H)-Pyrimidinone, 1-methyl-
The XLogP value of -0.5 indicates that 2(1H)-Pyrimidinone, 1-methyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.7 Ų, 2(1H)-Pyrimidinone, 1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Pyrimidinone, 1-methyl- has 0 hydrogen bond donor(s) and 1 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, 1-methyl-?
The CAS number of 2(1H)-Pyrimidinone, 1-methyl- is 3739-81-9.
What is the molecular formula of 2(1H)-Pyrimidinone, 1-methyl-?
The molecular formula of 2(1H)-Pyrimidinone, 1-methyl- is C5H6N2O.
What is the molecular weight of 2(1H)-Pyrimidinone, 1-methyl-?
The molecular weight of 2(1H)-Pyrimidinone, 1-methyl- is 110.05 g/mol.
Where can I buy 2(1H)-Pyrimidinone, 1-methyl-?
You can request a quote for 2(1H)-Pyrimidinone, 1-methyl- 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, 1-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Pyrimidinone, 1-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.