5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
TL;DR: 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide (CAS 201273-85-0) is a chemical compound with molecular formula C20H16N4OS2 and molecular weight 392.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-6-(cyanomethylsulfanyl)-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide, 5-cyano-6-(cyanomethylsulfanyl)-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide, 5-cyano-6-[(cyanomethyl)sulfanyl]-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C20H16N4OS2 |
|---|---|
| Molecular Weight | 392.08 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.07657 |
| Heavy Atoms | 27 |
| Complexity | 748.0 |
Chemical Identifiers
| CAS Number | 201273-85-0 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC#N)C#N)C2=CC=CS2)C(=O)NC3=CC=CC=C3 |
| InChIKey | AVTVGYRYHXSOLA-UHFFFAOYSA-N |
Product Overview
5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide (CAS 201273-85-0), with molecular formula C20H16N4OS2 and molecular weight 392.08 g/mol. IUPAC: 5-cyano-6-(cyanomethylsulfanyl)-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Property Insights of 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
The XLogP value of 3.3 indicates that 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-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 142.0 Ų indicates high polarity, suggesting 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide has 2 hydrogen bond donor(s) and 6 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-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
The CAS number of 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide is 201273-85-0.
What is the molecular formula of 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
The molecular formula of 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide is C20H16N4OS2.
What is the molecular weight of 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
The molecular weight of 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide is 392.08 g/mol.
Where can I buy 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
You can request a quote for 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-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-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-cyano-6-((cyanomethyl)thio)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.