4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
TL;DR: 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile (CAS 94833-56-4) is a chemical compound with molecular formula C24H19ClN2OS and molecular weight 418.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: 4-(4-chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile, AM-807/14957219, 4-(4-chlorophenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro-3-quinolinecarbonitrile, 4-(4-chlorophenyl)-2-((2-oxo-2-phenylethyl)thio)-5,6,7,8-tetrahydroquinoline-3-carbonitrile, 4-(4-chlorophenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
| Molecular Formula | C24H19ClN2OS |
|---|---|
| Molecular Weight | 418.09 g/mol |
| LogP | 6.12748 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.09067 |
| Heavy Atoms | 29 |
| Complexity | 1088.6038 |
Chemical Identifiers
| CAS Number | 94833-56-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=CC=C3)C#N)C4=CC=C(C=C4)Cl |
Product Overview
4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile (CAS 94833-56-4), with molecular formula C24H19ClN2OS and molecular weight 418.09 g/mol. IUPAC: 4-(4-chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Property Insights of 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
The XLogP value of 6.12748 indicates that 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.75 Ų, 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile 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 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile?
The CAS number of 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile is 94833-56-4.
What is the molecular formula of 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile?
The molecular formula of 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile is C24H19ClN2OS.
What is the molecular weight of 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile?
The molecular weight of 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile is 418.09 g/mol.
Where can I buy 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile?
You can request a quote for 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorophenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.