N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline
TL;DR: N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline (CAS 478048-59-8) is a chemical compound with molecular formula C21H19ClN2O2S and molecular weight 398.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline
Also Known As: Bionet1_003881, N-[(Z)-2-(6-chloro-3-pyridinyl)-2-(phenylsulfonyl)ethenyl]-3,4-dimethylaniline, N-[2-(benzenesulfonyl)-2-(6-chloropyridin-3-yl)ethenyl]-3,4-dimethylaniline
| Molecular Formula | C21H19ClN2O2S |
|---|---|
| Molecular Weight | 398.09 g/mol |
| LogP | 5.23624 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.08557 |
| Heavy Atoms | 27 |
| Complexity | 1076.9243 |
Chemical Identifiers
| CAS Number | 478048-59-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC=C(C2=CN=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)C |
Product Overview
N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline (CAS 478048-59-8), with molecular formula C21H19ClN2O2S and molecular weight 398.09 g/mol. IUPAC: N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline.
Chemical Property Profile of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline
Property Insights of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline
The XLogP value of 5.23624 indicates that N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline?
The CAS number of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline is 478048-59-8.
What is the molecular formula of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline?
The molecular formula of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline is C21H19ClN2O2S.
What is the molecular weight of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline?
The molecular weight of N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline is 398.09 g/mol.
Where can I buy N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline?
You can request a quote for N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(benzenesulfonyl)-2-(6-chloro-3-pyridinyl)ethenyl]-3,4-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.