5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide
TL;DR: 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide (CAS 303190-17-2) is a chemical compound with molecular formula C16H15N3OS and molecular weight 297.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-2,4-dimethyl-6-methylsulfanyl-N-phenylpyridine-3-carboxamide
Also Known As: BIM-0037300.P001, US9459250, E95, AB00100696-01, AE-848/11419267, 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide
| Molecular Formula | C16H15N3OS |
|---|---|
| Molecular Weight | 297.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.0936 |
| Heavy Atoms | 21 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 303190-17-2 |
|---|---|
| SMILES | CC1=C(C(=NC(=C1C(=O)NC2=CC=CC=C2)C)SC)C#N |
| InChIKey | KJJDYOHIROOAMK-UHFFFAOYSA-N |
Product Overview
5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide (CAS 303190-17-2), with molecular formula C16H15N3OS and molecular weight 297.09 g/mol. IUPAC: 5-cyano-2,4-dimethyl-6-methylsulfanyl-N-phenylpyridine-3-carboxamide.
Chemical Property Profile of 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide
Property Insights of 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide
The XLogP value of 3.0 indicates that 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide. Following Lipinski's Rule of Five, 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide has 1 hydrogen bond donor(s) and 4 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-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide?
The CAS number of 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide is 303190-17-2.
What is the molecular formula of 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide?
The molecular formula of 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide is C16H15N3OS.
What is the molecular weight of 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide?
The molecular weight of 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide is 297.09 g/mol.
Where can I buy 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide?
You can request a quote for 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 5-cyano-2,4-dimethyl-6-(methylsulfanyl)-N-phenylnicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.