5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one
TL;DR: 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one (CAS 21585-19-3) is a chemical compound with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one, 5-(2-Hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
| Molecular Formula | C13H14N2O3S |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 1.64289 |
| Topological Polar Surface Area | 78.11 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.0725 |
| Heavy Atoms | 19 |
| Complexity | 673.5231 |
Chemical Identifiers
| CAS Number | 21585-19-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C(=O)NC(=S)N2)CCO |
Product Overview
5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one (CAS 21585-19-3), with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol. IUPAC: 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one
Property Insights of 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one
The XLogP value of 1.64289 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one. The TPSA of 78.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one. Following Lipinski's Rule of Five, 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one has 3 hydrogen bond donor(s) and 4 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-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one?
The CAS number of 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one is 21585-19-3.
What is the molecular formula of 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one?
The molecular formula of 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one is C13H14N2O3S.
What is the molecular weight of 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one?
The molecular weight of 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one is 278.07 g/mol.
Where can I buy 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one?
You can request a quote for 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-hydroxyethyl)-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.