9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide
TL;DR: 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide (CAS 72739-01-6) is a chemical compound with molecular formula C21H18N4O3S and molecular weight 406.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[4-(methanesulfonamido)anilino]acridine-2-carboxamide
Also Known As: 9-((4-( -2-acridinecarboxamide, 9-[4-(methanesulfonamido)anilino]acridine-2-carboxamide, 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide, 2-Acridinecarboxamide, 9-((4-((methylsulfonyl)amino)phenyl)amino)-, 2-Acridinecarboxamide,9-[[4-[(methylsulfonyl)amino]phenyl]amino]-
| Molecular Formula | C21H18N4O3S |
|---|---|
| Molecular Weight | 406.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.10995 |
| Heavy Atoms | 29 |
| Complexity | 687.0 |
Chemical Identifiers
| CAS Number | 72739-01-6 |
|---|---|
| SMILES | CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC4=CC=CC=C42)C(=O)N |
| InChIKey | ZAVXCKSYRDQLKY-UHFFFAOYSA-N |
Product Overview
9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide (CAS 72739-01-6), with molecular formula C21H18N4O3S and molecular weight 406.11 g/mol. IUPAC: 9-[4-(methanesulfonamido)anilino]acridine-2-carboxamide.
Chemical Property Profile of 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide
Property Insights of 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide. Following Lipinski's Rule of Five, 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide has 3 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 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide?
The CAS number of 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide is 72739-01-6.
What is the molecular formula of 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide?
The molecular formula of 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide is C21H18N4O3S.
What is the molecular weight of 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide?
The molecular weight of 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide is 406.11 g/mol.
Where can I buy 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide?
You can request a quote for 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 9-((4-((Methylsulfonyl)amino)phenyl)amino)-2-acridinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.