N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine
TL;DR: N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine (CAS 23656-76-0) is a chemical compound with molecular formula C16H21NOS and molecular weight 275.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-1-phenylpropan-2-amine
Also Known As: IEM 533, N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-1-phenylpropan-2-amine, FURFURYLAMINE, N-(alpha-METHYLPHENETHYL)-5-((METHYLTHIO)METHYL)-, 2-Furanmethanamine, N-(1-methyl-2-phenylethyl)-5-((methylthio)methyl)-, alpha-Methyl-N-[5-(methylthiomethyl)furfuryl]benzeneethanamine
| Molecular Formula | C16H21NOS |
|---|---|
| Molecular Weight | 275.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 50.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 275.1344 |
| Heavy Atoms | 19 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 23656-76-0 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)NCC2=CC=C(O2)CSC |
| InChIKey | JNOMFANVVIDVGS-UHFFFAOYSA-N |
Product Overview
N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine (CAS 23656-76-0), with molecular formula C16H21NOS and molecular weight 275.13 g/mol. IUPAC: N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-1-phenylpropan-2-amine.
Chemical Property Profile of N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine
Property Insights of N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine
The XLogP value of 3.3 indicates that N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.5 Ų, N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine 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-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine?
The CAS number of N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine is 23656-76-0.
What is the molecular formula of N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine?
The molecular formula of N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine is C16H21NOS.
What is the molecular weight of N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine?
The molecular weight of N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine is 275.13 g/mol.
Where can I buy N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine?
You can request a quote for N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Methyl-2-phenylethyl)-5-((methylthio)methyl)-2-furanmethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.