2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide
TL;DR: 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide (CAS 73322-14-2) is a chemical compound with molecular formula C14H21IN2OS and molecular weight 392.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,6-trimethyl-2-methylsulfanyl-3-phenyl-5H-pyrimidin-4-ol;hydroiodide
Also Known As: 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide, 4-Pyrimidinol, 3,4,5,6-tetrahydro-2-methylthio-3-phenyl-4,6,6-trimethyl-, hydriodide, 4,6,6-trimethyl-2-methylsulfanyl-3-phenyl-5H-pyrimidin-4-ol hydroiodide, 4,6,6-Trimethyl-2-(methylsulfanyl)-3-phenyl-3,4,5,6-tetrahydropyrimidin-4-ol--hydrogen iodide (1/1), RefChem:1071570
| Molecular Formula | C14H21IN2OS |
|---|---|
| Molecular Weight | 392.04 g/mol |
| LogP | 3.7208 |
| Topological Polar Surface Area | 35.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 392.04193 |
| Heavy Atoms | 19 |
| Complexity | 459.7736 |
Chemical Identifiers
| CAS Number | 73322-14-2 |
|---|---|
| SMILES | CC1(CC(N(C(=N1)SC)C2=CC=CC=C2)(C)O)C.I |
Product Overview
2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide (CAS 73322-14-2), with molecular formula C14H21IN2OS and molecular weight 392.04 g/mol. IUPAC: 4,6,6-trimethyl-2-methylsulfanyl-3-phenyl-5H-pyrimidin-4-ol;hydroiodide.
Chemical Property Profile of 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide
Property Insights of 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide
The XLogP value of 3.7208 indicates that 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.83 Ų, 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide 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 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide?
The CAS number of 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide is 73322-14-2.
What is the molecular formula of 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide?
The molecular formula of 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide is C14H21IN2OS.
What is the molecular weight of 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide?
The molecular weight of 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide is 392.04 g/mol.
Where can I buy 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide?
You can request a quote for 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylthio-3-phenyl-4,6,6-trimethyl-3,4,5,6-tetrahydro-4-pyrimidinol hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.