N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine
TL;DR: N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine (CAS 744-67-2) is a chemical compound with molecular formula C22H29NS and molecular weight 339.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-1-[4-(benzylsulfanylmethyl)cyclohexyl]methanamine
Also Known As: N-benzyl-1-[4-(benzylsulfanylmethyl)cyclohexyl]methanamine, N-[[4-[[(Phenylmethyl)thio]methyl]cyclohexyl]methyl]benzenemethanamine, N-Benzyl-1-{4-[(benzylsulfanyl)methyl]cyclohexyl}methanamine, N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine, RefChem:359633
| Molecular Formula | C22H29NS |
|---|---|
| Molecular Weight | 339.20 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 339.20206 |
| Heavy Atoms | 24 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 744-67-2 |
|---|---|
| SMILES | C1CC(CCC1CNCC2=CC=CC=C2)CSCC3=CC=CC=C3 |
| InChIKey | FGQQXKVLDOVIBD-UHFFFAOYSA-N |
Product Overview
N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine (CAS 744-67-2), with molecular formula C22H29NS and molecular weight 339.20 g/mol. IUPAC: N-benzyl-1-[4-(benzylsulfanylmethyl)cyclohexyl]methanamine.
Chemical Property Profile of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine
Property Insights of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine
The XLogP value of 5.2 indicates that N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine?
The CAS number of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine is 744-67-2.
What is the molecular formula of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine?
The molecular formula of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine is C22H29NS.
What is the molecular weight of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine?
The molecular weight of N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine is 339.20 g/mol.
Where can I buy N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine?
You can request a quote for N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-((4-(((Phenylmethyl)thio)methyl)cyclohexyl)methyl)benzenemethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.