2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide
TL;DR: 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide (CAS 501442-23-5) is a chemical compound with molecular formula C13H12N2OS and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-N-pyridin-4-ylbenzamide
Also Known As: 2-(methylthio)-N-4-pyridinylbenzamide, 2-methylsulfanyl-N-pyridin-4-ylbenzamide, 2-(methylthio)-N-(pyridin-4-yl)benzamide, 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide
| Molecular Formula | C13H12N2OS |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 3.0558 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.06703 |
| Heavy Atoms | 17 |
| Complexity | 513.8377 |
Chemical Identifiers
| CAS Number | 501442-23-5 |
|---|---|
| SMILES | CSC1=CC=CC=C1C(=O)NC2=CC=NC=C2 |
Product Overview
2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide (CAS 501442-23-5), with molecular formula C13H12N2OS and molecular weight 244.07 g/mol. IUPAC: 2-methylsulfanyl-N-pyridin-4-ylbenzamide.
Chemical Property Profile of 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide
Property Insights of 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide
The XLogP value of 3.0558 indicates that 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide has 1 hydrogen bond donor(s) and 3 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 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide?
The CAS number of 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide is 501442-23-5.
What is the molecular formula of 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide?
The molecular formula of 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide is C13H12N2OS.
What is the molecular weight of 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide?
The molecular weight of 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide is 244.07 g/mol.
Where can I buy 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide?
You can request a quote for 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(methylsulfanyl)-N-(pyridin-4-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.