2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone
TL;DR: 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone (CAS 378209-29-1) is a chemical compound with molecular formula C24H25N3OS and molecular weight 403.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone
Also Known As: 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone, 2-(pyrimidin-2-ylsulfanyl)-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone, 2-(PYRIMIDIN-2-YLSULFANYL)-1-(2,2,4-TRIMETHYL-4-PHENYL-3H-QUINOLIN-1-YL)ETHANONE, 2-(pyrimidin-2-ylthio)-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
| Molecular Formula | C24H25N3OS |
|---|---|
| Molecular Weight | 403.17 g/mol |
| LogP | 5.0902 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.17184 |
| Heavy Atoms | 29 |
| Complexity | 1006.90393 |
Chemical Identifiers
| CAS Number | 378209-29-1 |
|---|---|
| SMILES | CC1(CC(C2=CC=CC=C2N1C(=O)CSC3=NC=CC=N3)(C)C4=CC=CC=C4)C |
Product Overview
2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone (CAS 378209-29-1), with molecular formula C24H25N3OS and molecular weight 403.17 g/mol. IUPAC: 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone.
Chemical Property Profile of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone
Property Insights of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone
The XLogP value of 5.0902 indicates that 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone?
The CAS number of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone is 378209-29-1.
What is the molecular formula of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone?
The molecular formula of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone is C24H25N3OS.
What is the molecular weight of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone?
The molecular weight of 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone is 403.17 g/mol.
Where can I buy 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone?
You can request a quote for 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-pyrimidin-2-ylsulfanyl-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.