N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide
TL;DR: N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide (CAS 851287-80-4) is a chemical compound with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-methylsulfanylpyridine-3-carboxamide
Also Known As: starbld0002297, N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide, N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-(methylsulfanyl)pyridine-3-carboxamide, N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-methylsulfanylpyridine-3-carboxamide
| Molecular Formula | C17H20N2O3S |
|---|---|
| Molecular Weight | 332.12 g/mol |
| LogP | 3.0929 |
| Topological Polar Surface Area | 51.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.11948 |
| Heavy Atoms | 23 |
| Complexity | 691.28876 |
Chemical Identifiers
| CAS Number | 851287-80-4 |
|---|---|
| SMILES | CN(CC1=C(C(=CC=C1)OC)OC)C(=O)C2=C(N=CC=C2)SC |
Product Overview
N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide (CAS 851287-80-4), with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol. IUPAC: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-methylsulfanylpyridine-3-carboxamide.
Chemical Property Profile of N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide
Property Insights of N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide
The XLogP value of 3.0929 indicates that N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.66 Ų, N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide has 0 hydrogen bond donor(s) and 5 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-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide?
The CAS number of N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide is 851287-80-4.
What is the molecular formula of N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide?
The molecular formula of N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide is C17H20N2O3S.
What is the molecular weight of N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide?
The molecular weight of N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide is 332.12 g/mol.
Where can I buy N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide?
You can request a quote for N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,3-Dimethoxybenzyl)-N-methyl-2-(methylthio)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.