N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride
TL;DR: N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride (CAS 1049699-18-4) is a chemical compound with molecular formula C14H17ClN2S and molecular weight 280.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylsulfanylphenyl)-N-(pyridin-3-ylmethyl)methanamine;hydrochloride
Also Known As: 1-(4-methylsulfanylphenyl)-N-(pyridin-3-ylmethyl)methanamine Hydrochloride, N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride
| Molecular Formula | C14H17ClN2S |
|---|---|
| Molecular Weight | 280.08 g/mol |
| LogP | 3.5151 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.0801 |
| Heavy Atoms | 18 |
| Complexity | 445.111 |
Chemical Identifiers
| CAS Number | 1049699-18-4 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)CNCC2=CN=CC=C2.Cl |
Product Overview
N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride (CAS 1049699-18-4), with molecular formula C14H17ClN2S and molecular weight 280.08 g/mol. IUPAC: 1-(4-methylsulfanylphenyl)-N-(pyridin-3-ylmethyl)methanamine;hydrochloride.
Chemical Property Profile of N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride
Property Insights of N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride
The XLogP value of 3.5151 indicates that N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.92 Ų, N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride 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 N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride?
The CAS number of N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride is 1049699-18-4.
What is the molecular formula of N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride?
The molecular formula of N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride is C14H17ClN2S.
What is the molecular weight of N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride?
The molecular weight of N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride is 280.08 g/mol.
Where can I buy N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride?
You can request a quote for N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(methylthio)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.