n-Butyl-2,4,5-trichlorobenzenesulfonamide
TL;DR: n-Butyl-2,4,5-trichlorobenzenesulfonamide (CAS 90876-56-5) is a chemical compound with molecular formula C10H12Cl3NO2S and molecular weight 314.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2,4,5-trichlorobenzenesulfonamide
Also Known As: n-Butyl-2,4,5-trichlorobenzenesulfonamide, butyl[(2,4,5-trichlorophenyl)sulfonyl]amine, n-Butyl-2,4,5-trichlorobenzenesulfonamide #, Benzenesulfonamide, n-butyl-2,4,5-trichloro-, A2582/0110073
| Molecular Formula | C10H12Cl3NO2S |
|---|---|
| Molecular Weight | 314.97 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.96542 |
| Heavy Atoms | 17 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 90876-56-5 |
|---|---|
| SMILES | CCCCNS(=O)(=O)C1=CC(=C(C=C1Cl)Cl)Cl |
| InChIKey | JOJDNFQDJKEBRK-UHFFFAOYSA-N |
Product Overview
n-Butyl-2,4,5-trichlorobenzenesulfonamide (CAS 90876-56-5), with molecular formula C10H12Cl3NO2S and molecular weight 314.97 g/mol. IUPAC: N-butyl-2,4,5-trichlorobenzenesulfonamide.
Chemical Property Profile of n-Butyl-2,4,5-trichlorobenzenesulfonamide
Property Insights of n-Butyl-2,4,5-trichlorobenzenesulfonamide
The XLogP value of 4.0 indicates that n-Butyl-2,4,5-trichlorobenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, n-Butyl-2,4,5-trichlorobenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl-2,4,5-trichlorobenzenesulfonamide has 1 hydrogen bond donor(s) and 3 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-Butyl-2,4,5-trichlorobenzenesulfonamide?
The CAS number of n-Butyl-2,4,5-trichlorobenzenesulfonamide is 90876-56-5.
What is the molecular formula of n-Butyl-2,4,5-trichlorobenzenesulfonamide?
The molecular formula of n-Butyl-2,4,5-trichlorobenzenesulfonamide is C10H12Cl3NO2S.
What is the molecular weight of n-Butyl-2,4,5-trichlorobenzenesulfonamide?
The molecular weight of n-Butyl-2,4,5-trichlorobenzenesulfonamide is 314.97 g/mol.
Where can I buy n-Butyl-2,4,5-trichlorobenzenesulfonamide?
You can request a quote for n-Butyl-2,4,5-trichlorobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Butyl-2,4,5-trichlorobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl-2,4,5-trichlorobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.