N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide
TL;DR: N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide (CAS 82-14-4) is a chemical compound with molecular formula C21H14ClNO4S and molecular weight 411.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-9,10-dioxoanthracen-1-yl)-4-methylbenzenesulfonamide
Also Known As: N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide, p-Toluenesulfonamide, N-(5-chloro-1-anthraquinonyl)-, N-(5-Chloro-1-anthraquinonyl)-p-toluenesulfonamide, N-(5-chloro-9,10-dioxoanthracen-1-yl)-4-methylbenzenesulfonamide, Benzenesulfonamide, N-(5-chloro-9,10-dihydro-9,10-dioxo-1-anthracenyl)-4-methyl-
| Molecular Formula | C21H14ClNO4S |
|---|---|
| Molecular Weight | 411.03 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 88.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 411.0332 |
| Heavy Atoms | 28 |
| Complexity | 725.0 |
Chemical Identifiers
| CAS Number | 82-14-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)Cl |
| InChIKey | AEYNFHFXCAPUQI-UHFFFAOYSA-N |
Product Overview
N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide (CAS 82-14-4), with molecular formula C21H14ClNO4S and molecular weight 411.03 g/mol. IUPAC: N-(5-chloro-9,10-dioxoanthracen-1-yl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide
Property Insights of N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide
The XLogP value of 4.9 indicates that N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide. Following Lipinski's Rule of Five, N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide has 1 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 N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide?
The CAS number of N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide is 82-14-4.
What is the molecular formula of N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide?
The molecular formula of N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide is C21H14ClNO4S.
What is the molecular weight of N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide?
The molecular weight of N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide is 411.03 g/mol.
Where can I buy N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide?
You can request a quote for N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-Chloro-9,10-dihydro-9,10-dioxo-1-anthryl)-p-toluenesulphonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.