5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
TL;DR: 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide (CAS 488745-08-0) is a chemical compound with molecular formula C25H28N4O3S2 and molecular weight 496.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-6-[2-(diethylamino)-2-oxoethyl]sulfanyl-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide, 5-cyano-6-[2-(diethylamino)-2-oxoethyl]sulfanyl-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide, 5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C25H28N4O3S2 |
|---|---|
| Molecular Weight | 496.16 g/mol |
| LogP | 4.69298 |
| Topological Polar Surface Area | 94.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 496.16028 |
| Heavy Atoms | 34 |
| Complexity | 1145.1606 |
Chemical Identifiers
| CAS Number | 488745-08-0 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=CC=C2OC)C3=CC=CS3)C#N |
Product Overview
5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide (CAS 488745-08-0), with molecular formula C25H28N4O3S2 and molecular weight 496.16 g/mol. IUPAC: 5-cyano-6-[2-(diethylamino)-2-oxoethyl]sulfanyl-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Property Insights of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
The XLogP value of 4.69298 indicates that 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide. Following Lipinski's Rule of Five, 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
The CAS number of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide is 488745-08-0.
What is the molecular formula of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
The molecular formula of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide is C25H28N4O3S2.
What is the molecular weight of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
The molecular weight of 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide is 496.16 g/mol.
Where can I buy 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
You can request a quote for 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-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-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-cyano-6-((2-(diethylamino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.