4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride
TL;DR: 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride (CAS 66725-15-3) is a chemical compound with molecular formula C42H38Cl2N6O4S2 and molecular weight 824.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-bis[4-(acridin-10-ium-9-ylamino)phenyl]butane-1,4-disulfonamide dichloride
Also Known As: 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride, 1,4-BUTANEDISULFONANILIDE, 4',4''-BIS(9-ACRIDINYLAMINO)-, DIHYDROCHLORIDE, N,N'-bis[4-(acridin-10-ium-9-ylamino)phenyl]butane-1,4-disulfonamide dichloride
| Molecular Formula | C42H38Cl2N6O4S2 |
|---|---|
| Molecular Weight | 824.18 g/mol |
| LogP | 2.39 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 824.1773 |
| Heavy Atoms | 56 |
| Complexity | 1260.0 |
Chemical Identifiers
| CAS Number | 66725-15-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=[NH+]2)NC4=CC=C(C=C4)NS(=O)(=O)CCCCS(=O)(=O)NC5=CC=C(C=C5)NC6=C7C=CC=CC7=[NH+]C8=CC=CC=C86.[Cl-].[Cl-] |
| InChIKey | QYPHZJBBGLAYQI-UHFFFAOYSA-N |
Product Overview
4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride (CAS 66725-15-3), with molecular formula C42H38Cl2N6O4S2 and molecular weight 824.18 g/mol. IUPAC: N,N'-bis[4-(acridin-10-ium-9-ylamino)phenyl]butane-1,4-disulfonamide dichloride.
Chemical Property Profile of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride
Property Insights of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride
The XLogP value of 2.39 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride. The TPSA of 161.0 Ų indicates high polarity, suggesting 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride?
The CAS number of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride is 66725-15-3.
What is the molecular formula of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride?
The molecular formula of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride is C42H38Cl2N6O4S2.
What is the molecular weight of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride?
The molecular weight of 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride is 824.18 g/mol.
Where can I buy 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride?
You can request a quote for 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4',4''-Bis(9-acridinylamino)-1,4-butanesulfonanilide dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.