BBE3EPJ2JA
TL;DR: BBE3EPJ2JA (CAS 63404-69-3) is a chemical compound with molecular formula C26H20N4O8 and molecular weight 516.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-acetylimino-7,14-dihydroxy-4,11-dimethoxy-6,13-dioxo-5,12-dihydroquinolino[2,3-b]acridin-8-ylidene)acetamide
Also Known As: Quino[2,3-b]acridine,acetamide deriv., Quino[2,3-b]acridine, acetamide deriv., Acetamide, N,N'-(5,6,7,12,13,14-hexahydro-4,11-dimethoxy-6,7,13,14-tetraoxoquino(2,3-b)acridine-1,8-diyl)bis-, N,N'-(4,11-Dimethoxy-6,7,13,14-tetraoxo-5,6,7,12,13,14-hexahydroquinolino[2,3-b]acridine-1,8-diyl)diacetamide, N-(1-acetamido-4,11-dimethoxy-6,7,13,14-tetraoxo-5,12-dihydroquinolino[2,3-b]acridin-8-yl)acetamide
| Molecular Formula | C26H20N4O8 |
|---|---|
| Molecular Weight | 516.13 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 176.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 516.1281 |
| Heavy Atoms | 38 |
| Complexity | 1500.0 |
Chemical Identifiers
| CAS Number | 63404-69-3 |
|---|---|
| SMILES | CC(=O)N=C1C=CC(=C2C1=C(C3=C(N2)C(=O)C4=C(C3=O)NC5=C(C=CC(=NC(=O)C)C5=C4O)OC)O)OC |
| InChIKey | GOEZLFSUXDZXGW-UHFFFAOYSA-N |
Product Overview
BBE3EPJ2JA (CAS 63404-69-3), with molecular formula C26H20N4O8 and molecular weight 516.13 g/mol. IUPAC: N-(1-acetylimino-7,14-dihydroxy-4,11-dimethoxy-6,13-dioxo-5,12-dihydroquinolino[2,3-b]acridin-8-ylidene)acetamide.
Chemical Property Profile of BBE3EPJ2JA
Property Insights of BBE3EPJ2JA
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BBE3EPJ2JA. The TPSA of 176.0 Ų indicates high polarity, suggesting BBE3EPJ2JA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BBE3EPJ2JA has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BBE3EPJ2JA?
The CAS number of BBE3EPJ2JA is 63404-69-3.
What is the molecular formula of BBE3EPJ2JA?
The molecular formula of BBE3EPJ2JA is C26H20N4O8.
What is the molecular weight of BBE3EPJ2JA?
The molecular weight of BBE3EPJ2JA is 516.13 g/mol.
Where can I buy BBE3EPJ2JA?
You can request a quote for BBE3EPJ2JA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BBE3EPJ2JA?
Yes, KEHONG BIO provides custom synthesis services for BBE3EPJ2JA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.