4-(Bis(2-chloroethyl)amino)benzenesulfonamide
TL;DR: 4-(Bis(2-chloroethyl)amino)benzenesulfonamide (CAS 2045-41-2) is a chemical compound with molecular formula C10H14Cl2N2O2S and molecular weight 296.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(2-chloroethyl)amino]benzenesulfonamide
Also Known As: 4-[bis(2-chloroethyl)amino]benzenesulfonamide, di(2-chloroethyl)sulfanilamide, N4,N4-Bis-(2-chlor-ethyl)-sulfanilamid, Sulfanilamide, N4,N4-bis(2-chloroethyl)-, Sulfanilamide, N(sup 4),N(sup 4)-bis(2-chloroethyl)-
| Molecular Formula | C10H14Cl2N2O2S |
|---|---|
| Molecular Weight | 296.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.0153 |
| Heavy Atoms | 17 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 2045-41-2 |
|---|---|
| SMILES | C1=CC(=CC=C1N(CCCl)CCCl)S(=O)(=O)N |
| InChIKey | PRZVDHWOIZGGKL-UHFFFAOYSA-N |
Product Overview
4-(Bis(2-chloroethyl)amino)benzenesulfonamide (CAS 2045-41-2), with molecular formula C10H14Cl2N2O2S and molecular weight 296.02 g/mol. IUPAC: 4-[bis(2-chloroethyl)amino]benzenesulfonamide.
Chemical Property Profile of 4-(Bis(2-chloroethyl)amino)benzenesulfonamide
Property Insights of 4-(Bis(2-chloroethyl)amino)benzenesulfonamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Bis(2-chloroethyl)amino)benzenesulfonamide. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Bis(2-chloroethyl)amino)benzenesulfonamide. Following Lipinski's Rule of Five, 4-(Bis(2-chloroethyl)amino)benzenesulfonamide has 1 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 4-(Bis(2-chloroethyl)amino)benzenesulfonamide?
The CAS number of 4-(Bis(2-chloroethyl)amino)benzenesulfonamide is 2045-41-2.
What is the molecular formula of 4-(Bis(2-chloroethyl)amino)benzenesulfonamide?
The molecular formula of 4-(Bis(2-chloroethyl)amino)benzenesulfonamide is C10H14Cl2N2O2S.
What is the molecular weight of 4-(Bis(2-chloroethyl)amino)benzenesulfonamide?
The molecular weight of 4-(Bis(2-chloroethyl)amino)benzenesulfonamide is 296.02 g/mol.
Where can I buy 4-(Bis(2-chloroethyl)amino)benzenesulfonamide?
You can request a quote for 4-(Bis(2-chloroethyl)amino)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Bis(2-chloroethyl)amino)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(Bis(2-chloroethyl)amino)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.