2,3-Dimethyl-4(3H)-pyrimidinone
TL;DR: 2,3-Dimethyl-4(3H)-pyrimidinone (CAS 17758-38-2) is a chemical compound with molecular formula C6H8N2O and molecular weight 124.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethylpyrimidin-4-one
Also Known As: 2,3-dimethylpyrimidin-4-one, 2,3-Dimethyl-4(3H)-pyrimidinone, 2,3-Dimethylpyrimidin-4(3H)-one, 2,3-dimethyl-3h-pyrimidin-4-one, 4(3H)-Pyrimidinone, 2,3-dimethyl-
| Molecular Formula | C6H8N2O |
|---|---|
| Molecular Weight | 124.06 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 124.06366 |
| Heavy Atoms | 9 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 17758-38-2 |
|---|---|
| SMILES | CC1=NC=CC(=O)N1C |
| InChIKey | AHQSDTAPZOQQBJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Dimethyl-4(3H)-pyrimidinone (CAS 17758-38-2), with molecular formula C6H8N2O and molecular weight 124.06 g/mol. IUPAC: 2,3-dimethylpyrimidin-4-one.
Chemical Property Profile of 2,3-Dimethyl-4(3H)-pyrimidinone
Property Insights of 2,3-Dimethyl-4(3H)-pyrimidinone
The XLogP value of -0.5 indicates that 2,3-Dimethyl-4(3H)-pyrimidinone 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, 2,3-Dimethyl-4(3H)-pyrimidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethyl-4(3H)-pyrimidinone 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 2,3-Dimethyl-4(3H)-pyrimidinone?
The CAS number of 2,3-Dimethyl-4(3H)-pyrimidinone is 17758-38-2.
What is the molecular formula of 2,3-Dimethyl-4(3H)-pyrimidinone?
The molecular formula of 2,3-Dimethyl-4(3H)-pyrimidinone is C6H8N2O.
What is the molecular weight of 2,3-Dimethyl-4(3H)-pyrimidinone?
The molecular weight of 2,3-Dimethyl-4(3H)-pyrimidinone is 124.06 g/mol.
Where can I buy 2,3-Dimethyl-4(3H)-pyrimidinone?
You can request a quote for 2,3-Dimethyl-4(3H)-pyrimidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethyl-4(3H)-pyrimidinone?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethyl-4(3H)-pyrimidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.