![4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol structure](/static/products/795/79538-29-7.png)
4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol
TL;DR: 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol (CAS 79538-29-7) 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.
4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenol
Also Known As: 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol, Peakdale1_000023, 4-((4,6-Dimethylpyrimidin-2-yl)thio)phenol, 4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenol, 4-bromomethyl-7-methoxycoumarin
| Molecular Formula | C12H12N2OS |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.95024 |
| Topological Polar Surface Area | 46.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.06703 |
| Heavy Atoms | 16 |
| Complexity | 476.62198 |
Chemical Identifiers
| CAS Number | 79538-29-7 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SC2=CC=C(C=C2)O)C |
Product Overview
4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol (CAS 79538-29-7), with molecular formula C12H12N2OS and molecular weight 232.07 g/mol. IUPAC: 4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenol.
Chemical Property Profile of 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol
Property Insights of 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol
The XLogP value of 2.95024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol. With a topological polar surface area (TPSA) of 46.01 Ų, 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol has 1 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 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol?
The CAS number of 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol is 79538-29-7.
What is the molecular formula of 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol?
The molecular formula of 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol is C12H12N2OS.
What is the molecular weight of 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol?
The molecular weight of 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol is 232.07 g/mol.
Where can I buy 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol?
You can request a quote for 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.