![2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide structure](/static/products/872/872097-29-5.png)
2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide
TL;DR: 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide (CAS 872097-29-5) is a chemical compound with molecular formula C18H22N2OS and molecular weight 314.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-N-[2-(4-propan-2-ylphenyl)ethyl]pyridine-3-carboxamide
Also Known As: AB00744660-01, 2-methylsulfanyl-N-[2-(4-propan-2-ylphenyl)ethyl]pyridine-3-carboxamide, 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide
| Molecular Formula | C18H22N2OS |
|---|---|
| Molecular Weight | 314.15 g/mol |
| LogP | 3.8994 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.1453 |
| Heavy Atoms | 22 |
| Complexity | 623.2392 |
Chemical Identifiers
| CAS Number | 872097-29-5 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)CCNC(=O)C2=C(N=CC=C2)SC |
Product Overview
2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide (CAS 872097-29-5), with molecular formula C18H22N2OS and molecular weight 314.15 g/mol. IUPAC: 2-methylsulfanyl-N-[2-(4-propan-2-ylphenyl)ethyl]pyridine-3-carboxamide.
Chemical Property Profile of 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide
Property Insights of 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide
The XLogP value of 3.8994 indicates that 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide 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-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide 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-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide?
The CAS number of 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide is 872097-29-5.
What is the molecular formula of 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide?
The molecular formula of 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide is C18H22N2OS.
What is the molecular weight of 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide?
The molecular weight of 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide is 314.15 g/mol.
Where can I buy 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide?
You can request a quote for 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide 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-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(methylsulfanyl)-N-{2-[4-(propan-2-yl)phenyl]ethyl}pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.