n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide
TL;DR: n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide (CAS 2794-56-1) is a chemical compound with molecular formula C10H12Cl2FNO2S and molecular weight 299.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-4-fluorobenzenesulfonamide
Also Known As: NCIOpen2_002248, n,n-bis(2-chloroethyl)-4-fluorobenzenesulfonamide, Benzenesulfonamide,n,n-bis(2-chloroethyl)-4-fluoro-, N,N-Bis(2-chloroethyl)-4-fluorobenzene-1-sulfonamide, N,N-BIS(2-CHLOROETHYL)-4-FLUORO-BENZENESULFONAMIDE
| Molecular Formula | C10H12Cl2FNO2S |
|---|---|
| Molecular Weight | 299.00 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.995 |
| Heavy Atoms | 17 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 2794-56-1 |
|---|---|
| SMILES | C1=CC(=CC=C1F)S(=O)(=O)N(CCCl)CCCl |
| InChIKey | CHCDXCVZZXLUDN-UHFFFAOYSA-N |
Product Overview
n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide (CAS 2794-56-1), with molecular formula C10H12Cl2FNO2S and molecular weight 299.00 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-fluorobenzenesulfonamide.
Chemical Property Profile of n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide
Property Insights of n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide. With a topological polar surface area (TPSA) of 45.8 Ų, n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide has 0 hydrogen bond donor(s) and 4 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 n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide?
The CAS number of n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide is 2794-56-1.
What is the molecular formula of n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide?
The molecular formula of n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide is C10H12Cl2FNO2S.
What is the molecular weight of n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide?
The molecular weight of n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide is 299.00 g/mol.
Where can I buy n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide?
You can request a quote for n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for n,n-Bis(2-chloroethyl)-4-fluorobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.