AB01289953-01
TL;DR: AB01289953-01 (CAS 1002008-57-2) is a chemical compound with molecular formula C22H18N6O3S2 and molecular weight 478.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(2-methoxyphenyl)methylamino]quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide
Also Known As: AB01289953-01, N-(3-((2-methoxybenzyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide, N-[3-[(2-methoxyphenyl)methylamino]quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide
| Molecular Formula | C22H18N6O3S2 |
|---|---|
| Molecular Weight | 478.09 g/mol |
| LogP | 4.056 |
| Topological Polar Surface Area | 118.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.0882 |
| Heavy Atoms | 33 |
| Complexity | 1569.3282 |
Chemical Identifiers
| CAS Number | 1002008-57-2 |
|---|---|
| SMILES | COC1=CC=CC=C1CNC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC5=NSN=C54 |
Product Overview
AB01289953-01 (CAS 1002008-57-2), with molecular formula C22H18N6O3S2 and molecular weight 478.09 g/mol. IUPAC: N-[3-[(2-methoxyphenyl)methylamino]quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide.
Chemical Property Profile of AB01289953-01
Property Insights of AB01289953-01
The XLogP value of 4.056 indicates that AB01289953-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01289953-01. Following Lipinski's Rule of Five, AB01289953-01 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 AB01289953-01?
The CAS number of AB01289953-01 is 1002008-57-2.
What is the molecular formula of AB01289953-01?
The molecular formula of AB01289953-01 is C22H18N6O3S2.
What is the molecular weight of AB01289953-01?
The molecular weight of AB01289953-01 is 478.09 g/mol.
Where can I buy AB01289953-01?
You can request a quote for AB01289953-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01289953-01?
Yes, KEHONG BIO provides custom synthesis services for AB01289953-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.