![4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide structure](/static/products/7745/774546-70-2.webp)
4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide
TL;DR: 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide (CAS 774546-70-2) is a chemical compound with molecular formula C15H15BrClN3O4S and molecular weight 446.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide
Also Known As: 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide, 4-bromo-N-[3-[(2-chloro-4-nitro-phenyl)amino]propyl]benzenesulfonamide, 4-bromo-N-{3-[(2-chloro-4-nitrophenyl)amino]propyl}benzenesulfonamide
| Molecular Formula | C15H15BrClN3O4S |
|---|---|
| Molecular Weight | 446.97 g/mol |
| LogP | 3.7912 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 446.9655 |
| Heavy Atoms | 25 |
| Complexity | 859.58026 |
Chemical Identifiers
| CAS Number | 774546-70-2 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Br |
Product Overview
4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide (CAS 774546-70-2), with molecular formula C15H15BrClN3O4S and molecular weight 446.97 g/mol. IUPAC: 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide.
Chemical Property Profile of 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide
Property Insights of 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide
The XLogP value of 3.7912 indicates that 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide has 2 hydrogen bond donor(s) and 5 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-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide?
The CAS number of 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide is 774546-70-2.
What is the molecular formula of 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide?
The molecular formula of 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide is C15H15BrClN3O4S.
What is the molecular weight of 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide?
The molecular weight of 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide is 446.97 g/mol.
Where can I buy 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide?
You can request a quote for 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.