RefChem:563830
TL;DR: RefChem:563830 (CAS 2907-79-1) is a chemical compound with molecular formula C27H20N2O5S and molecular weight 484.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-amino-9,10-dioxo-3-phenoxyanthracen-1-yl)-4-methylbenzenesulfonamide
Also Known As: n-4-methylbenzenesulphonamide, N- -4-methylbenzenesulphonamide, 1-Amino-2-phenoxy-4-(((4-methylphenyl)sulfonyl)amino)anthraquinone, Benzenesulfonamide, N-(4-amino-9,10-dihydro-9,10-dioxo-3-phenoxy-1-anthracenyl)-4-methyl-, N-(4-Amino-9,10-dihydro-9,10-dioxo-3-phenoxy-1-anthryl)-4-methylbenzenesulphonamide
| Molecular Formula | C27H20N2O5S |
|---|---|
| Molecular Weight | 484.11 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 484.10928 |
| Heavy Atoms | 35 |
| Complexity | 888.0 |
Chemical Identifiers
| CAS Number | 2907-79-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OC5=CC=CC=C5 |
| InChIKey | VOOHPYUBEFOAEZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:563830 (CAS 2907-79-1), with molecular formula C27H20N2O5S and molecular weight 484.11 g/mol. IUPAC: N-(4-amino-9,10-dioxo-3-phenoxyanthracen-1-yl)-4-methylbenzenesulfonamide.
Chemical Property Profile of RefChem:563830
Property Insights of RefChem:563830
The XLogP value of 5.7 indicates that RefChem:563830 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:563830. Following Lipinski's Rule of Five, RefChem:563830 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:563830?
The CAS number of RefChem:563830 is 2907-79-1.
What is the molecular formula of RefChem:563830?
The molecular formula of RefChem:563830 is C27H20N2O5S.
What is the molecular weight of RefChem:563830?
The molecular weight of RefChem:563830 is 484.11 g/mol.
Where can I buy RefChem:563830?
You can request a quote for RefChem:563830 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:563830?
Yes, KEHONG BIO provides custom synthesis services for RefChem:563830 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.