1,3,4-trimethyl-4H-pyrimidin-2-one
TL;DR: 1,3,4-trimethyl-4H-pyrimidin-2-one (CAS 45740-64-5) is a chemical compound with molecular formula C7H12N2O and molecular weight 140.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4-trimethyl-4H-pyrimidin-2-one
Also Known As: 1,3,4-trimethyl-4H-pyrimidin-2-one, 5,6-Dihydro-1,3,4-trimethyl-2 -pyrimidinone, 3,4-Dihydro-1,3,4-trimethyl-2(1H)-pyrimidone, 1,3,4-trimethyl-1,2,3,4-tetrahydropyrimidin-2-one
| Molecular Formula | C7H12N2O |
|---|---|
| Molecular Weight | 140.09 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.09496 |
| Heavy Atoms | 10 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 45740-64-5 |
|---|---|
| SMILES | CC1C=CN(C(=O)N1C)C |
| InChIKey | WAYDNYGUKUTTCL-UHFFFAOYSA-N |
Product Overview
1,3,4-trimethyl-4H-pyrimidin-2-one (CAS 45740-64-5), with molecular formula C7H12N2O and molecular weight 140.09 g/mol. IUPAC: 1,3,4-trimethyl-4H-pyrimidin-2-one.
Chemical Property Profile of 1,3,4-trimethyl-4H-pyrimidin-2-one
Property Insights of 1,3,4-trimethyl-4H-pyrimidin-2-one
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-trimethyl-4H-pyrimidin-2-one. With a topological polar surface area (TPSA) of 23.6 Ų, 1,3,4-trimethyl-4H-pyrimidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-trimethyl-4H-pyrimidin-2-one 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 1,3,4-trimethyl-4H-pyrimidin-2-one?
The CAS number of 1,3,4-trimethyl-4H-pyrimidin-2-one is 45740-64-5.
What is the molecular formula of 1,3,4-trimethyl-4H-pyrimidin-2-one?
The molecular formula of 1,3,4-trimethyl-4H-pyrimidin-2-one is C7H12N2O.
What is the molecular weight of 1,3,4-trimethyl-4H-pyrimidin-2-one?
The molecular weight of 1,3,4-trimethyl-4H-pyrimidin-2-one is 140.09 g/mol.
Where can I buy 1,3,4-trimethyl-4H-pyrimidin-2-one?
You can request a quote for 1,3,4-trimethyl-4H-pyrimidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-trimethyl-4H-pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-trimethyl-4H-pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.