2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone
TL;DR: 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone (CAS 429652-66-4) is a chemical compound with molecular formula C16H18N2O2S and molecular weight 302.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone
Also Known As: BAS 03014662, AP-048/15613031, 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone, 2-(4,6-Dimethyl-pyrimidin-2-ylsulfanyl)-1-(4-methoxy-3-methyl-phenyl)-ethanone, 2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]-1-(4-methoxy-3-methylphenyl)ethanone
| Molecular Formula | C16H18N2O2S |
|---|---|
| Molecular Weight | 302.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.1089 |
| Heavy Atoms | 21 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 429652-66-4 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SCC(=O)C2=CC(=C(C=C2)OC)C)C |
| InChIKey | ATEVFQZXDLCONM-UHFFFAOYSA-N |
Product Overview
2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone (CAS 429652-66-4), with molecular formula C16H18N2O2S and molecular weight 302.11 g/mol. IUPAC: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone.
Chemical Property Profile of 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone
Property Insights of 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone
The XLogP value of 3.6 indicates that 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone. Following Lipinski's Rule of Five, 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone 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-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone?
The CAS number of 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone is 429652-66-4.
What is the molecular formula of 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone?
The molecular formula of 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone is C16H18N2O2S.
What is the molecular weight of 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone?
The molecular weight of 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone is 302.11 g/mol.
Where can I buy 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone?
You can request a quote for 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-1-(4-methoxy-3-methylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.