N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide
TL;DR: N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide (CAS 5587-76-8) is a chemical compound with molecular formula C12H18Cl2N4O2S and molecular weight 352.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide
Also Known As: N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide, n,n-bis(2-chloroethyl)-4-[(1e)-3,3-dimethyltriaz-1-en-1-yl]benzenesulfonamide
| Molecular Formula | C12H18Cl2N4O2S |
|---|---|
| Molecular Weight | 352.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 352.05276 |
| Heavy Atoms | 21 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 5587-76-8 |
|---|---|
| SMILES | CN(C)N=NC1=CC=C(C=C1)S(=O)(=O)N(CCCl)CCCl |
| InChIKey | RUCGNYIKNLXDNS-UHFFFAOYSA-N |
Product Overview
N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide (CAS 5587-76-8), with molecular formula C12H18Cl2N4O2S and molecular weight 352.05 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide.
Chemical Property Profile of N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide
Property Insights of N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide. Following Lipinski's Rule of Five, N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide has 0 hydrogen bond donor(s) and 6 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-(dimethylaminodiazenyl)benzenesulfonamide?
The CAS number of N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide is 5587-76-8.
What is the molecular formula of N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide?
The molecular formula of N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide is C12H18Cl2N4O2S.
What is the molecular weight of N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide?
The molecular weight of N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide is 352.05 g/mol.
Where can I buy N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide?
You can request a quote for N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide 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-(dimethylaminodiazenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(2-chloroethyl)-4-(dimethylaminodiazenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.