N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide
TL;DR: N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide (CAS 687570-41-8) is a chemical compound with molecular formula C17H17N3OS and molecular weight 311.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]pyridine-4-carboxamide
Also Known As: N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide, AB01287093-01, N-{2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl}pyridine-4-carboxamide, F0582-0200, N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]pyridine-4-carboxamide
| Molecular Formula | C17H17N3OS |
|---|---|
| Molecular Weight | 311.11 g/mol |
| LogP | 3.39342 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.10922 |
| Heavy Atoms | 22 |
| Complexity | 782.9582 |
Chemical Identifiers
| CAS Number | 687570-41-8 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)SCCNC(=O)C3=CC=NC=C3 |
Product Overview
N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide (CAS 687570-41-8), with molecular formula C17H17N3OS and molecular weight 311.11 g/mol. IUPAC: N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]pyridine-4-carboxamide.
Chemical Property Profile of N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide
Property Insights of N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide
The XLogP value of 3.39342 indicates that N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.78 Ų, N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide has 2 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 N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide?
The CAS number of N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide is 687570-41-8.
What is the molecular formula of N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide?
The molecular formula of N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide is C17H17N3OS.
What is the molecular weight of N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide?
The molecular weight of N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide is 311.11 g/mol.
Where can I buy N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide?
You can request a quote for N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)isonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.