![N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide structure](/static/products/5478/5478-49-9.webp)
N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide
TL;DR: N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide (CAS 5478-49-9) is a chemical compound with molecular formula C14H14ClN3O4S and molecular weight 355.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chloro-2-nitroanilino)ethyl]benzenesulfonamide
Also Known As: BAS 00434920, N-{2-[(4-chloro-2-nitrophenyl)amino]ethyl}benzenesulfonamide, N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide, N-[2-(4-Chloro-2-nitroanilino)ethyl]benzenesulfonamide, N-(2-{4-chloro-2-nitroanilino}ethyl)benzenesulfonamide
| Molecular Formula | C14H14ClN3O4S |
|---|---|
| Molecular Weight | 355.04 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.03937 |
| Heavy Atoms | 23 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 5478-49-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NCCNC2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
| InChIKey | BNFUQHXBLOXZCU-UHFFFAOYSA-N |
Product Overview
N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide (CAS 5478-49-9), with molecular formula C14H14ClN3O4S and molecular weight 355.04 g/mol. IUPAC: N-[2-(4-chloro-2-nitroanilino)ethyl]benzenesulfonamide.
Chemical Property Profile of N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide
Property Insights of N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide
The XLogP value of 3.6 indicates that N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide. Following Lipinski's Rule of Five, N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide has 2 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-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide?
The CAS number of N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide is 5478-49-9.
What is the molecular formula of N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide?
The molecular formula of N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide is C14H14ClN3O4S.
What is the molecular weight of N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide?
The molecular weight of N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide is 355.04 g/mol.
Where can I buy N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide?
You can request a quote for N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-Chloro-2-nitro-phenylamino)-ethyl]-benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.