Benzyl-dimethyl-(phenylsulfanylmethyl)azanium
TL;DR: Benzyl-dimethyl-(phenylsulfanylmethyl)azanium (CAS 7154-02-1) is a chemical compound with molecular formula C16H20NS+ and molecular weight 258.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-dimethyl-(phenylsulfanylmethyl)azanium
Also Known As: NCIOpen2_002294, benzyl-dimethyl-(phenylsulfanylmethyl)azanium, N,N-Dimethyl(phenyl)-N-[(phenylsulfanyl)methyl]methanaminium
| Molecular Formula | C16H20NS+ |
|---|---|
| Molecular Weight | 258.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.13165 |
| Heavy Atoms | 18 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 7154-02-1 |
|---|---|
| SMILES | C[N+](C)(CC1=CC=CC=C1)CSC2=CC=CC=C2 |
| InChIKey | FTZRCQHVKQRFSF-UHFFFAOYSA-N |
Product Overview
Benzyl-dimethyl-(phenylsulfanylmethyl)azanium (CAS 7154-02-1), with molecular formula C16H20NS+ and molecular weight 258.13 g/mol. IUPAC: benzyl-dimethyl-(phenylsulfanylmethyl)azanium.
Chemical Property Profile of Benzyl-dimethyl-(phenylsulfanylmethyl)azanium
Property Insights of Benzyl-dimethyl-(phenylsulfanylmethyl)azanium
The XLogP value of 4.1 indicates that Benzyl-dimethyl-(phenylsulfanylmethyl)azanium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Benzyl-dimethyl-(phenylsulfanylmethyl)azanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl-dimethyl-(phenylsulfanylmethyl)azanium has 0 hydrogen bond donor(s) and 1 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 Benzyl-dimethyl-(phenylsulfanylmethyl)azanium?
The CAS number of Benzyl-dimethyl-(phenylsulfanylmethyl)azanium is 7154-02-1.
What is the molecular formula of Benzyl-dimethyl-(phenylsulfanylmethyl)azanium?
The molecular formula of Benzyl-dimethyl-(phenylsulfanylmethyl)azanium is C16H20NS+.
What is the molecular weight of Benzyl-dimethyl-(phenylsulfanylmethyl)azanium?
The molecular weight of Benzyl-dimethyl-(phenylsulfanylmethyl)azanium is 258.13 g/mol.
Where can I buy Benzyl-dimethyl-(phenylsulfanylmethyl)azanium?
You can request a quote for Benzyl-dimethyl-(phenylsulfanylmethyl)azanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl-dimethyl-(phenylsulfanylmethyl)azanium?
Yes, KEHONG BIO provides custom synthesis services for Benzyl-dimethyl-(phenylsulfanylmethyl)azanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.