4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide
TL;DR: 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide (CAS 370844-49-8) is a chemical compound with molecular formula C30H25ClN4O2S and molecular weight 540.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-5-cyano-6-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenylpyridine-3-carboxamide
Also Known As: 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide, 4-(4-chlorophenyl)-5-cyano-6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenylpyridine-3-carboxamide, 4-(4-chlorophenyl)-5-cyano-6-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenylpyridine-3-carboxamide
| Molecular Formula | C30H25ClN4O2S |
|---|---|
| Molecular Weight | 540.14 g/mol |
| LogP | 7.1276 |
| Topological Polar Surface Area | 94.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 540.1387 |
| Heavy Atoms | 38 |
| Complexity | 1499.0168 |
Chemical Identifiers
| CAS Number | 370844-49-8 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CSC2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)Cl)C(=O)NC4=CC=CC=C4)C |
Product Overview
4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide (CAS 370844-49-8), with molecular formula C30H25ClN4O2S and molecular weight 540.14 g/mol. IUPAC: 4-(4-chlorophenyl)-5-cyano-6-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenylpyridine-3-carboxamide.
Chemical Property Profile of 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide
Property Insights of 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide
The XLogP value of 7.1276 indicates that 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide. Following Lipinski's Rule of Five, 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide has 2 hydrogen bond donor(s) and 5 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)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide?
The CAS number of 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide is 370844-49-8.
What is the molecular formula of 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide?
The molecular formula of 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide is C30H25ClN4O2S.
What is the molecular weight of 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide?
The molecular weight of 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide is 540.14 g/mol.
Where can I buy 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide?
You can request a quote for 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide 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)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-chlorophenyl)-5-cyano-6-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenylnicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.