![5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one structure](/static/products/2849/28495-91-2.webp)
5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
TL;DR: 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one (CAS 28495-91-2) is a chemical compound with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-ethoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 5-[3-Ethoxybenzyl]-2-thiouracil, 5-[(3-ethoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-on, 5-[(3-ethoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one, 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one, 5-[(3-ethoxyphenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
| Molecular Formula | C13H14N2O2S |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 2.42199 |
| Topological Polar Surface Area | 57.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.0776 |
| Heavy Atoms | 18 |
| Complexity | 645.67975 |
Chemical Identifiers
| CAS Number | 28495-91-2 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)CC2=CNC(=S)NC2=O |
Product Overview
5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one (CAS 28495-91-2), with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol. IUPAC: 5-[(3-ethoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Property Insights of 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
The XLogP value of 2.42199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one. With a topological polar surface area (TPSA) of 57.88 Ų, 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one has 2 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 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one?
The CAS number of 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one is 28495-91-2.
What is the molecular formula of 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one?
The molecular formula of 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one is C13H14N2O2S.
What is the molecular weight of 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one?
The molecular weight of 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one is 262.08 g/mol.
Where can I buy 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one?
You can request a quote for 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[(3-Ethoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.