Pyrazoloacridine mesylate
TL;DR: Pyrazoloacridine mesylate (CAS 99009-21-9) is a chemical compound with molecular formula C20H25N5O6S and molecular weight 463.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanesulfonic acid;3-(4-methoxy-10-nitro-8,14,15-triazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9,11,13(16)-heptaen-14-yl)-N,N-dimethylpropan-1-amine
Also Known As: pyrazoloacridine mesylate, Pyrazoloacridine, 2-(3-(Dimethylamino)propyl)-5-(hydroxy(oxido)amino)-9-methoxy-2,6-dihydropyrazolo(3,4,5-kl)acridine methanesulfonate, methanesulfonic acid;3-(4-methoxy-10-nitro-8,14,15-triazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9,11,13(16)-heptaen-14-yl)-N,N-dimethylpropan-1-amine, methanesulfonic acid; 3-[methoxy(nitro)[?]yl]-N,N-dimethyl-propan-1-amine
| Molecular Formula | C20H25N5O6S |
|---|---|
| Molecular Weight | 463.15 g/mol |
| LogP | 3.1328 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 463.15256 |
| Heavy Atoms | 32 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 99009-21-9 |
|---|---|
| SMILES | CN(C)CCCN1C2=C3C(=C(C=C2)[N+](=O)[O-])NC4=C(C3=N1)C=C(C=C4)OC.CS(=O)(=O)O |
| InChIKey | OKVKOKPUEQTYKI-UHFFFAOYSA-N |
Product Overview
Pyrazoloacridine mesylate (CAS 99009-21-9), with molecular formula C20H25N5O6S and molecular weight 463.15 g/mol. IUPAC: methanesulfonic acid;3-(4-methoxy-10-nitro-8,14,15-triazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9,11,13(16)-heptaen-14-yl)-N,N-dimethylpropan-1-amine.
Chemical Property Profile of Pyrazoloacridine mesylate
Property Insights of Pyrazoloacridine mesylate
The XLogP value of 3.1328 indicates that Pyrazoloacridine mesylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting Pyrazoloacridine mesylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyrazoloacridine mesylate has 2 hydrogen bond donor(s) and 9 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 Pyrazoloacridine mesylate?
The CAS number of Pyrazoloacridine mesylate is 99009-21-9.
What is the molecular formula of Pyrazoloacridine mesylate?
The molecular formula of Pyrazoloacridine mesylate is C20H25N5O6S.
What is the molecular weight of Pyrazoloacridine mesylate?
The molecular weight of Pyrazoloacridine mesylate is 463.15 g/mol.
Where can I buy Pyrazoloacridine mesylate?
You can request a quote for Pyrazoloacridine mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazoloacridine mesylate?
Yes, KEHONG BIO provides custom synthesis services for Pyrazoloacridine mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.