Bis(2-benzylthioethyl)amine
TL;DR: Bis(2-benzylthioethyl)amine (CAS 52785-92-9) is a chemical compound with molecular formula C18H23NS2 and molecular weight 317.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-N-(2-benzylsulfanylethyl)ethanamine
Also Known As: Bis(2-benzylthioethyl)amine, Bis[2-(benzylthio)ethyl]amine, bis-(2-benzylsulfanyl-ethyl)-amine, 1,9-Diphenyl-5-aza-2,8-dithianonane, BIS[2-(BENZYLSULFANYL)ETHYL]AMINE
| Molecular Formula | C18H23NS2 |
|---|---|
| Molecular Weight | 317.13 g/mol |
| LogP | 4.4428 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 317.1272 |
| Heavy Atoms | 21 |
| Complexity | 427.5917 |
Chemical Identifiers
| CAS Number | 52785-92-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCCNCCSCC2=CC=CC=C2 |
Product Overview
Bis(2-benzylthioethyl)amine (CAS 52785-92-9), with molecular formula C18H23NS2 and molecular weight 317.13 g/mol. IUPAC: 2-benzylsulfanyl-N-(2-benzylsulfanylethyl)ethanamine.
Chemical Property Profile of Bis(2-benzylthioethyl)amine
Property Insights of Bis(2-benzylthioethyl)amine
The XLogP value of 4.4428 indicates that Bis(2-benzylthioethyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, Bis(2-benzylthioethyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-benzylthioethyl)amine 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 Bis(2-benzylthioethyl)amine?
The CAS number of Bis(2-benzylthioethyl)amine is 52785-92-9.
What is the molecular formula of Bis(2-benzylthioethyl)amine?
The molecular formula of Bis(2-benzylthioethyl)amine is C18H23NS2.
What is the molecular weight of Bis(2-benzylthioethyl)amine?
The molecular weight of Bis(2-benzylthioethyl)amine is 317.13 g/mol.
Where can I buy Bis(2-benzylthioethyl)amine?
You can request a quote for Bis(2-benzylthioethyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-benzylthioethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-benzylthioethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.