![N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline structure](/static/products/959/959-25-1.png)
N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline
TL;DR: N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline (CAS 959-25-1) is a chemical compound with molecular formula C15H16ClNS and molecular weight 277.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)sulfanylmethyl]-N,4-dimethylaniline
Also Known As: NCIOpen2_005747, N-[(4-chlorophenyl)sulfanylmethyl]-N,4-dimethylaniline, N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline
| Molecular Formula | C15H16ClNS |
|---|---|
| Molecular Weight | 277.07 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.06918 |
| Heavy Atoms | 18 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 959-25-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N(C)CSC2=CC=C(C=C2)Cl |
| InChIKey | XUBPYBGXBKAKFU-UHFFFAOYSA-N |
Product Overview
N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline (CAS 959-25-1), with molecular formula C15H16ClNS and molecular weight 277.07 g/mol. IUPAC: N-[(4-chlorophenyl)sulfanylmethyl]-N,4-dimethylaniline.
Chemical Property Profile of N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline
Property Insights of N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline
The XLogP value of 5.3 indicates that N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline has 0 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-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline?
The CAS number of N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline is 959-25-1.
What is the molecular formula of N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline?
The molecular formula of N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline is C15H16ClNS.
What is the molecular weight of N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline?
The molecular weight of N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline is 277.07 g/mol.
Where can I buy N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline?
You can request a quote for N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-{[(4-Chlorophenyl)sulfanyl]methyl}-N,4-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.