RefChem:811468
TL;DR: RefChem:811468 (CAS 68385-96-6) is a chemical compound with molecular formula C20H22N6O2S and molecular weight 410.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2,6-dicyano-4-methylphenyl)diazenyl]-5-(diethylamino)phenyl]methanesulfonamide
Also Known As: Methanesulfonamide, N-[2-[(2,6-dicyano-4-methylphenyl)azo]-5-(diethylamino)phenyl]-, N-(2-((2,6-Dicyano-p-tolyl)azo)-5-(diethylamino)phenyl)methanesulphonamide, N-[2-[(2,6-dicyano-4-methylphenyl)diazenyl]-5-(diethylamino)phenyl]methanesulfonamide, Benzenamine, N,N-diethyl-3-((methylsulfonyl)amino)-4-((2,6-dicyano-4-methylphenyl)azo))-, Methanesulfonamide, N-(2-((2,6-dicyano-4-methylphenyl)azo)-5-(diethylamino)phenyl)-
| Molecular Formula | C20H22N6O2S |
|---|---|
| Molecular Weight | 410.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.1525 |
| Heavy Atoms | 29 |
| Complexity | 744.0 |
Chemical Identifiers
| CAS Number | 68385-96-6 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)C)C#N)NS(=O)(=O)C |
| InChIKey | NSLHLMXJNOITEZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:811468 (CAS 68385-96-6), with molecular formula C20H22N6O2S and molecular weight 410.15 g/mol. IUPAC: N-[2-[(2,6-dicyano-4-methylphenyl)diazenyl]-5-(diethylamino)phenyl]methanesulfonamide.
Chemical Property Profile of RefChem:811468
Property Insights of RefChem:811468
The XLogP value of 3.3 indicates that RefChem:811468 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:811468. Following Lipinski's Rule of Five, RefChem:811468 has 1 hydrogen bond donor(s) and 8 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 RefChem:811468?
The CAS number of RefChem:811468 is 68385-96-6.
What is the molecular formula of RefChem:811468?
The molecular formula of RefChem:811468 is C20H22N6O2S.
What is the molecular weight of RefChem:811468?
The molecular weight of RefChem:811468 is 410.15 g/mol.
Where can I buy RefChem:811468?
You can request a quote for RefChem:811468 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:811468?
Yes, KEHONG BIO provides custom synthesis services for RefChem:811468 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.