UPCMLD0ENAT0506-6465:001
TL;DR: UPCMLD0ENAT0506-6465:001 (CAS 352660-16-3) is a chemical compound with molecular formula C25H26ClN3OS and molecular weight 451.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-chlorophenyl)-2,2,4-trimethyl-3H-quinolin-1-yl]-2-(4-methylpyrimidin-2-yl)sulfanylethanone
Also Known As: UPCMLD0ENAT0506-6465:001, 1-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-[(4-methylpyrimidin-2-yl)sulfanyl]ethanone, AJ-292/14826014, 1-(4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)-2-((4-methylpyrimidin-2-yl)thio)ethanone, 1-[4-(4-chlorophenyl)-2,2,4-trimethyl(1,2,3,4-tetrahydroquinolyl)]-2-(4-methyl pyrimidin-2-ylthio)ethan-1-one
| Molecular Formula | C25H26ClN3OS |
|---|---|
| Molecular Weight | 451.15 g/mol |
| LogP | 6.05202 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.1485 |
| Heavy Atoms | 31 |
| Complexity | 1115.7598 |
Chemical Identifiers
| CAS Number | 352660-16-3 |
|---|---|
| SMILES | CC1=NC(=NC=C1)SCC(=O)N2C3=CC=CC=C3C(CC2(C)C)(C)C4=CC=C(C=C4)Cl |
Product Overview
UPCMLD0ENAT0506-6465:001 (CAS 352660-16-3), with molecular formula C25H26ClN3OS and molecular weight 451.15 g/mol. IUPAC: 1-[4-(4-chlorophenyl)-2,2,4-trimethyl-3H-quinolin-1-yl]-2-(4-methylpyrimidin-2-yl)sulfanylethanone.
Chemical Property Profile of UPCMLD0ENAT0506-6465:001
Property Insights of UPCMLD0ENAT0506-6465:001
The XLogP value of 6.05202 indicates that UPCMLD0ENAT0506-6465:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, UPCMLD0ENAT0506-6465:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0506-6465:001 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 UPCMLD0ENAT0506-6465:001?
The CAS number of UPCMLD0ENAT0506-6465:001 is 352660-16-3.
What is the molecular formula of UPCMLD0ENAT0506-6465:001?
The molecular formula of UPCMLD0ENAT0506-6465:001 is C25H26ClN3OS.
What is the molecular weight of UPCMLD0ENAT0506-6465:001?
The molecular weight of UPCMLD0ENAT0506-6465:001 is 451.15 g/mol.
Where can I buy UPCMLD0ENAT0506-6465:001?
You can request a quote for UPCMLD0ENAT0506-6465:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0506-6465:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0506-6465:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.