4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride
TL;DR: 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride (CAS 111880-48-9) is a chemical compound with molecular formula C25H22ClN3O3S and molecular weight 479.10703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-(benzo[a]acridin-12-ylamino)-3-methoxyphenyl]methanesulfonamide;hydrochloride
Also Known As: 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride, N-[4-(benzo[a]acridin-12-ylamino)-3-methoxyphenyl]methanesulfonamide hydrochloride, N-{4-[(Benzo[a]acridin-12(7H)-ylidene)amino]-3-methoxyphenyl}methanesulfonamide--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C25H22ClN3O3S |
| Molecular Weight | 479.10703 g/mol |
| XLogP | 6.0867 |
| Topological Polar Surface Area (TPSA) | 88.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 479.10703 Da |
| Heavy Atoms | 33 |
| Complexity | 741.0 |
| SMILES | COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C(=NC4=CC=CC=C42)C=CC5=CC=CC=C53.Cl |
| InChIKey | OFXDTFFKIHXEDC-UHFFFAOYSA-N |
Chemical Property Profile of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride
Property Insights of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride
The XLogP value of 6.0867 indicates that 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride. Following Lipinski's Rule of Five, 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride?
The CAS number of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride is 111880-48-9.
What is the molecular formula of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride?
The molecular formula of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride is C25H22ClN3O3S.
What is the molecular weight of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride?
The molecular weight of 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride is 479.10703 g/mol.
Where can I buy 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride?
You can request a quote for 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride?
Yes, CoreyChem provides custom synthesis services for 4-(12-Benz(a)acridinylamino)-3-methoxymethanesulfonanilide dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.