![2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine structure](/static/products/401/401595-14-0.png)
2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine
TL;DR: 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine (CAS 401595-14-0) is a chemical compound with molecular formula C12H12N2OS and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methoxyphenyl)methylsulfanyl]pyrimidine
Also Known As: 2-[(2-methoxybenzyl)sulfanyl]pyrimidine, 2-[(2-methoxyphenyl)methylsulfanyl]pyrimidine, Pyrimidine, 2-[[(2-methoxyphenyl)methyl]thio]-, 2-methoxy-1-(pyrimidin-2-ylthiomethyl)benzene, 2-(2-Methoxybenzylthio)-pyrimidine (0.1 H2O)
| Molecular Formula | C12H12N2OS |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.06703 |
| Heavy Atoms | 16 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 401595-14-0 |
|---|---|
| SMILES | COC1=CC=CC=C1CSC2=NC=CC=N2 |
| InChIKey | XDGDXXBXMWZEHH-UHFFFAOYSA-N |
Product Overview
2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine (CAS 401595-14-0), with molecular formula C12H12N2OS and molecular weight 232.07 g/mol. IUPAC: 2-[(2-methoxyphenyl)methylsulfanyl]pyrimidine.
Chemical Property Profile of 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine
Property Insights of 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine. Following Lipinski's Rule of Five, 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine has 0 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 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine?
The CAS number of 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine is 401595-14-0.
What is the molecular formula of 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine?
The molecular formula of 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine is C12H12N2OS.
What is the molecular weight of 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine?
The molecular weight of 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine is 232.07 g/mol.
Where can I buy 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine?
You can request a quote for 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Methoxyphenyl)methylsulfanyl]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.