2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione
TL;DR: 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione (CAS 180907-94-2) is a chemical compound with molecular formula C14H17NS and molecular weight 231.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,4-trimethyl-5-phenyl-1,3-dihydropyridine-6-thione
Also Known As: 2,2,4-trimethyl-5-phenyl-1,3-dihydropyridine-6-thione, 4,6,6-trimethyl-3-phenyl-5,6-dihydropyridine-2(1H)-thione, 3-Phenyl-4,6,6-trimethyl-5,6-dihydropyridine-2(1H)-thione, 4,6,6-Trimethyl-3-phenyl-5,6-dihydro-1H-pyridine-2-thione, 4,6,6-trimethyl-3-phenyl-5,6-dihydro-2(1H)-pyridinethione
| Molecular Formula | C14H17NS |
|---|---|
| Molecular Weight | 231.11 g/mol |
| LogP | 3.5594 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.10817 |
| Heavy Atoms | 16 |
| Complexity | 443.06296 |
Chemical Identifiers
| CAS Number | 180907-94-2 |
|---|---|
| SMILES | CC1=C(C(=S)NC(C1)(C)C)C2=CC=CC=C2 |
Product Overview
2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione (CAS 180907-94-2), with molecular formula C14H17NS and molecular weight 231.11 g/mol. IUPAC: 2,2,4-trimethyl-5-phenyl-1,3-dihydropyridine-6-thione.
Chemical Property Profile of 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione
Property Insights of 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione
The XLogP value of 3.5594 indicates that 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione has 1 hydrogen bond donor(s) and 1 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 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione?
The CAS number of 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione is 180907-94-2.
What is the molecular formula of 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione?
The molecular formula of 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione is C14H17NS.
What is the molecular weight of 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione?
The molecular weight of 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione is 231.11 g/mol.
Where can I buy 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione?
You can request a quote for 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4-Trimethyl-5-phenyl-1,3-dihydropyridine-6-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.