AQ-390/42869058
TL;DR: AQ-390/42869058 (CAS 794552-74-2) is a chemical compound with molecular formula C27H22N2O5S and molecular weight 486.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-N-(1-methyl-2-oxobenzo[cd]indol-6-yl)sulfonyl-2-phenylacetamide
Also Known As: AQ-390/42869058, N-(4-methoxyphenyl)-1-methyl-2-oxo-N-(phenylacetyl)-1,2-dihydrobenzo[cd]indole-6-sulfonamide, N-(4-methoxyphenyl)-N-(1-methyl-2-oxobenzo[cd]indol-6-yl)sulfonyl-2-phenylacetamide
| Molecular Formula | C27H22N2O5S |
|---|---|
| Molecular Weight | 486.12 g/mol |
| LogP | 4.403 |
| Topological Polar Surface Area | 83.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 486.12494 |
| Heavy Atoms | 35 |
| Complexity | 1565.0094 |
Chemical Identifiers
| CAS Number | 794552-74-2 |
|---|---|
| SMILES | CN1C2=C3C(=C(C=C2)S(=O)(=O)N(C4=CC=C(C=C4)OC)C(=O)CC5=CC=CC=C5)C=CC=C3C1=O |
Product Overview
AQ-390/42869058 (CAS 794552-74-2), with molecular formula C27H22N2O5S and molecular weight 486.12 g/mol. IUPAC: N-(4-methoxyphenyl)-N-(1-methyl-2-oxobenzo[cd]indol-6-yl)sulfonyl-2-phenylacetamide.
Chemical Property Profile of AQ-390/42869058
Property Insights of AQ-390/42869058
The XLogP value of 4.403 indicates that AQ-390/42869058 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-390/42869058. Following Lipinski's Rule of Five, AQ-390/42869058 has 0 hydrogen bond donor(s) and 5 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 AQ-390/42869058?
The CAS number of AQ-390/42869058 is 794552-74-2.
What is the molecular formula of AQ-390/42869058?
The molecular formula of AQ-390/42869058 is C27H22N2O5S.
What is the molecular weight of AQ-390/42869058?
The molecular weight of AQ-390/42869058 is 486.12 g/mol.
Where can I buy AQ-390/42869058?
You can request a quote for AQ-390/42869058 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-390/42869058?
Yes, KEHONG BIO provides custom synthesis services for AQ-390/42869058 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.