2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine
TL;DR: 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine (CAS 646511-19-5) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dimethoxyphenyl)sulfanylpyrimidine
Also Known As: 2-(2,5-dimethoxyphenyl)sulfanylpyrimidine, m-nitroxymethyl benzoic acid, 2-(2,5-Dimethoxybenzenethio)pyrimidine, Pyrimidine, 2-[(2,5-dimethoxyphenyl)thio]-, 2-[(2,5-DIMETHOXYPHENYL)SULFANYL]PYRIMIDINE
| Molecular Formula | C12H12N2O2S |
|---|---|
| Molecular Weight | 248.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 69.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.06195 |
| Heavy Atoms | 17 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 646511-19-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)SC2=NC=CC=N2 |
| InChIKey | LDVLJUCWBKESAD-UHFFFAOYSA-N |
Product Overview
2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine (CAS 646511-19-5), with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol. IUPAC: 2-(2,5-dimethoxyphenyl)sulfanylpyrimidine.
Chemical Property Profile of 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine
Property Insights of 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine. The TPSA of 69.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine. Following Lipinski's Rule of Five, 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine has 0 hydrogen bond donor(s) and 5 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-(2,5-Dimethoxyphenyl)sulfanylpyrimidine?
The CAS number of 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine is 646511-19-5.
What is the molecular formula of 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine?
The molecular formula of 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine is C12H12N2O2S.
What is the molecular weight of 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine?
The molecular weight of 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine is 248.06 g/mol.
Where can I buy 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine?
You can request a quote for 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,5-Dimethoxyphenyl)sulfanylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.