m-AMSA gluconate salt
TL;DR: m-AMSA gluconate salt (CAS 80277-07-2) is a chemical compound with molecular formula C27H31N3O10S and molecular weight 589.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide;2,3,4,5,6-pentahydroxyhexanoic acid
Also Known As: Amsacrine gluconate, m-AMSA gluconate salt, Methanesulfonamide, N-(4-(9-acridinylamino)-3-methoxyphenyl)-, mono-d-gluconate, D-Gluconic acid, compd. with N-(4-(9-acridinylamino)-3-methoxyphenyl)methanesulfonamide (1:1), D-Gluconic acid, compd. with N-[4-(9-acridinylamino)-3-methoxyphenyl]methanesulfonamide (1:1)
| Molecular Formula | C27H31N3O10S |
|---|---|
| Molecular Weight | 589.17 g/mol |
| LogP | 1.0186 |
| Topological Polar Surface Area | 227.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 10 |
| Exact Mass | 589.17303 |
| Heavy Atoms | 41 |
| Complexity | 771.0 |
Chemical Identifiers
| CAS Number | 80277-07-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42.C(C(C(C(C(C(=O)O)O)O)O)O)O |
| InChIKey | XXNAQBNJPZNRSZ-UHFFFAOYSA-N |
Product Overview
m-AMSA gluconate salt (CAS 80277-07-2), with molecular formula C27H31N3O10S and molecular weight 589.17 g/mol. IUPAC: N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide;2,3,4,5,6-pentahydroxyhexanoic acid.
Chemical Property Profile of m-AMSA gluconate salt
Property Insights of m-AMSA gluconate salt
The XLogP value of 1.0186 suggests moderate lipophilicity, balancing water solubility and membrane permeability for m-AMSA gluconate salt. The TPSA of 227.0 Ų indicates high polarity, suggesting m-AMSA gluconate salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, m-AMSA gluconate salt has 8 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of m-AMSA gluconate salt?
The CAS number of m-AMSA gluconate salt is 80277-07-2.
What is the molecular formula of m-AMSA gluconate salt?
The molecular formula of m-AMSA gluconate salt is C27H31N3O10S.
What is the molecular weight of m-AMSA gluconate salt?
The molecular weight of m-AMSA gluconate salt is 589.17 g/mol.
Where can I buy m-AMSA gluconate salt?
You can request a quote for m-AMSA gluconate salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-AMSA gluconate salt?
Yes, KEHONG BIO provides custom synthesis services for m-AMSA gluconate salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.