Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide
TL;DR: Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide (CAS 39597-28-9) is a chemical compound with molecular formula C15H21IN2S and molecular weight 388.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,6-trimethyl-1-(4-methylphenyl)-2-methylsulfanylpyrimidine;hydroiodide
Also Known As: 3,4-Dibrom-adipinsaeure-diaethylester, 2-Methylthio-3-(p-tolyl)-4,6,6-trimethyl-3,6-dihydropyrimidine hydriodide, Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide, 4,4,6-trimethyl-1-(4-methylphenyl)-2-(methylsulfanyl)-1,4-dihydropyrimidine hydroiodide(1:1), 4,4,6-trimethyl-1-(4-methylphenyl)-2-methylsulfanyl-pyrimidine hydroiodide
| Molecular Formula | C15H21IN2S |
|---|---|
| Molecular Weight | 388.05 g/mol |
| LogP | 4.83442 |
| Topological Polar Surface Area | 40.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 388.04703 |
| Heavy Atoms | 19 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 39597-28-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=CC(N=C2SC)(C)C)C.I |
| InChIKey | GRRDNHYJZRFVGS-UHFFFAOYSA-N |
Product Overview
Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide (CAS 39597-28-9), with molecular formula C15H21IN2S and molecular weight 388.05 g/mol. IUPAC: 4,4,6-trimethyl-1-(4-methylphenyl)-2-methylsulfanylpyrimidine;hydroiodide.
Chemical Property Profile of Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide
Property Insights of Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide
The XLogP value of 4.83442 indicates that Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.9 Ų, Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide has 1 hydrogen bond donor(s) and 2 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 Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide?
The CAS number of Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide is 39597-28-9.
What is the molecular formula of Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide?
The molecular formula of Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide is C15H21IN2S.
What is the molecular weight of Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide?
The molecular weight of Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide is 388.05 g/mol.
Where can I buy Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide?
You can request a quote for Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 3,6-dihydro-2-methylthio-3-(p-tolyl)-4,6,6-trimethyl-, hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.