6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile
TL;DR: 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile (CAS 370073-91-9) is a chemical compound with molecular formula C29H17ClN2O3S and molecular weight 508.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-chlorophenyl)-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-4-phenylpyridine-3-carbonitrile
Also Known As: 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile, 6-(4-chlorophenyl)-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile, 6-(4-chlorophenyl)-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-4-phenylpyridine-3-carbonitrile, 6-(4-chlorophenyl)-2-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-4-phenylpyridine-3-carbonitrile
| Molecular Formula | C29H17ClN2O3S |
|---|---|
| Molecular Weight | 508.06 g/mol |
| LogP | 7.02208 |
| Topological Polar Surface Area | 83.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 508.06485 |
| Heavy Atoms | 36 |
| Complexity | 1690.9657 |
Chemical Identifiers
| CAS Number | 370073-91-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C5=CC=C(C=C5)Cl |
Product Overview
6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile (CAS 370073-91-9), with molecular formula C29H17ClN2O3S and molecular weight 508.06 g/mol. IUPAC: 6-(4-chlorophenyl)-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-4-phenylpyridine-3-carbonitrile.
Chemical Property Profile of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile
Property Insights of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile
The XLogP value of 7.02208 indicates that 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile. Following Lipinski's Rule of Five, 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile?
The CAS number of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile is 370073-91-9.
What is the molecular formula of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile?
The molecular formula of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile is C29H17ClN2O3S.
What is the molecular weight of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile?
The molecular weight of 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile is 508.06 g/mol.
Where can I buy 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile?
You can request a quote for 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(4-chlorophenyl)-2-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)-4-phenylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.