5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide
TL;DR: 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide (CAS 671769-63-4) is a chemical compound with molecular formula C31H30N4O3S and molecular weight 538.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Also Known As: 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide, 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-phenyl-1,4-dihydropyridine-3-carboxamide, 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C31H30N4O3S |
|---|---|
| Molecular Weight | 538.20 g/mol |
| LogP | 6.1003 |
| Topological Polar Surface Area | 103.25 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 538.20386 |
| Heavy Atoms | 39 |
| Complexity | 1439.9044 |
Chemical Identifiers
| CAS Number | 671769-63-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=CC=C(C=C4)C)C#N |
Product Overview
5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide (CAS 671769-63-4), with molecular formula C31H30N4O3S and molecular weight 538.20 g/mol. IUPAC: 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide
Property Insights of 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide
The XLogP value of 6.1003 indicates that 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide. Following Lipinski's Rule of Five, 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide has 3 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 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide?
The CAS number of 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide is 671769-63-4.
What is the molecular formula of 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide?
The molecular formula of 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide is C31H30N4O3S.
What is the molecular weight of 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide?
The molecular weight of 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide is 538.20 g/mol.
Where can I buy 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide?
You can request a quote for 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-(p-tolylamino)ethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.