5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine
TL;DR: 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine (CAS 98841-37-3) is a chemical compound with molecular formula C9H14N2O2 and molecular weight 182.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-4-ethyl-6-methyl-3,4-dihydro-1H-pyrimidin-2-one
Also Known As: 5-aceto-6-methyl-4-ethyl-3,4-dihydropyrimidin-2-(1H)-One, 5-acetyl-4-ethyl-6-methyl-3,4-dihydro-1H-pyrimidin-2-one, 5-acetyl-4-ethyl-6-methyl-3,4-dihydropyrimidin-2(1H)-one, 5-acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine, A2042/0085853
| Molecular Formula | C9H14N2O2 |
|---|---|
| Molecular Weight | 182.11 g/mol |
| LogP | 0.9408 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.10553 |
| Heavy Atoms | 13 |
| Complexity | 281.3393 |
Chemical Identifiers
| CAS Number | 98841-37-3 |
|---|---|
| SMILES | CCC1C(=C(NC(=O)N1)C)C(=O)C |
Product Overview
5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine (CAS 98841-37-3), with molecular formula C9H14N2O2 and molecular weight 182.11 g/mol. IUPAC: 5-acetyl-4-ethyl-6-methyl-3,4-dihydro-1H-pyrimidin-2-one.
Chemical Property Profile of 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine
Property Insights of 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine
The XLogP value of 0.9408 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine. With a topological polar surface area (TPSA) of 58.2 Ų, 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine has 2 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 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine?
The CAS number of 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine is 98841-37-3.
What is the molecular formula of 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine?
The molecular formula of 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine is C9H14N2O2.
What is the molecular weight of 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine?
The molecular weight of 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine is 182.11 g/mol.
Where can I buy 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine?
You can request a quote for 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-6-ethyl-4-methyl-2-oxo-1,3,6-trihydropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.