4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide
TL;DR: 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide (CAS 37862-60-5) is a chemical compound with molecular formula C16H12N2O4S and molecular weight 328.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,4-dioxonaphthalen-1-yl)amino]benzenesulfonamide
Also Known As: NCI60_012568, 4-(4-Sulfamylanilino)-1,2-naphthoquinone, UPCMLD0ENAT0501-3512:001, 4-[(3,4-dioxonaphthalen-1-yl)amino]benzenesulfonamide, AB00090108-01
| Molecular Formula | C16H12N2O4S |
|---|---|
| Molecular Weight | 328.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.0518 |
| Heavy Atoms | 23 |
| Complexity | 627.0 |
Chemical Identifiers
| CAS Number | 37862-60-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=O)C2=O)NC3=CC=C(C=C3)S(=O)(=O)N |
| InChIKey | DIHFBNUDSJVTRQ-UHFFFAOYSA-N |
Product Overview
4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide (CAS 37862-60-5), with molecular formula C16H12N2O4S and molecular weight 328.05 g/mol. IUPAC: 4-[(3,4-dioxonaphthalen-1-yl)amino]benzenesulfonamide.
Chemical Property Profile of 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide
Property Insights of 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide. Following Lipinski's Rule of Five, 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]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 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide?
The CAS number of 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide is 37862-60-5.
What is the molecular formula of 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide?
The molecular formula of 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide is C16H12N2O4S.
What is the molecular weight of 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide?
The molecular weight of 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide is 328.05 g/mol.
Where can I buy 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide?
You can request a quote for 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.