3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine
TL;DR: 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine (CAS 27314-77-8) is a chemical compound with molecular formula C20H19N5O2S and molecular weight 393.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(3,6-diaminoacridin-9-yl)amino]phenyl]methanesulfonamide
Also Known As: 3,6-Diamino-amsa, 3,6-diamino-9-(4- aminoacridine, 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine, N-[4-[(3,6-diaminoacridin-9-yl)amino]phenyl]methanesulfonamide, n-{4-[(3,6-diaminoacridin-9-yl)amino]phenyl}methanesulfonamide
| Molecular Formula | C20H19N5O2S |
|---|---|
| Molecular Weight | 393.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.12595 |
| Heavy Atoms | 28 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 27314-77-8 |
|---|---|
| SMILES | CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=C2C=CC(=C4)N)N |
| InChIKey | DFPFHWONJWGBDW-UHFFFAOYSA-N |
Product Overview
3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine (CAS 27314-77-8), with molecular formula C20H19N5O2S and molecular weight 393.13 g/mol. IUPAC: N-[4-[(3,6-diaminoacridin-9-yl)amino]phenyl]methanesulfonamide.
Chemical Property Profile of 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine
Property Insights of 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine. Following Lipinski's Rule of Five, 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine has 4 hydrogen bond donor(s) and 7 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 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine?
The CAS number of 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine is 27314-77-8.
What is the molecular formula of 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine?
The molecular formula of 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine is C20H19N5O2S.
What is the molecular weight of 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine?
The molecular weight of 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine is 393.13 g/mol.
Where can I buy 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine?
You can request a quote for 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Diamino-9-(4-(methylsulfonyl)aminophenyl)aminoacridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.