AO-299/40798988
TL;DR: AO-299/40798988 (CAS 496966-45-1) is a chemical compound with molecular formula C26H21BrN2O3S and molecular weight 520.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[[3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: AO-299/40798988, 2-{3-bromo-5-ethoxy-4-[(4-methylbenzyl)oxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, (2Z)-2-{3-bromo-5-ethoxy-4-[(4-methylbenzyl)oxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, (2Z)-2-[[3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
| Molecular Formula | C26H21BrN2O3S |
|---|---|
| Molecular Weight | 520.05 g/mol |
| LogP | 5.50552 |
| Topological Polar Surface Area | 52.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.04565 |
| Heavy Atoms | 33 |
| Complexity | 1571.7416 |
Chemical Identifiers
| CAS Number | 496966-45-1 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N3C4=CC=CC=C4N=C3S2)Br)OCC5=CC=C(C=C5)C |
Product Overview
AO-299/40798988 (CAS 496966-45-1), with molecular formula C26H21BrN2O3S and molecular weight 520.05 g/mol. IUPAC: (2Z)-2-[[3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of AO-299/40798988
Property Insights of AO-299/40798988
The XLogP value of 5.50552 indicates that AO-299/40798988 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.83 Ų, AO-299/40798988 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-299/40798988 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-299/40798988?
The CAS number of AO-299/40798988 is 496966-45-1.
What is the molecular formula of AO-299/40798988?
The molecular formula of AO-299/40798988 is C26H21BrN2O3S.
What is the molecular weight of AO-299/40798988?
The molecular weight of AO-299/40798988 is 520.05 g/mol.
Where can I buy AO-299/40798988?
You can request a quote for AO-299/40798988 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-299/40798988?
Yes, KEHONG BIO provides custom synthesis services for AO-299/40798988 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.