AN-989/41262852
TL;DR: AN-989/41262852 (CAS 469906-35-2) is a chemical compound with molecular formula C18H13BrN2O3S and molecular weight 415.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(5-bromo-2,3-dimethoxyphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: AN-989/41262852, (2Z)-2-(5-bromo-2,3-dimethoxybenzylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, (Z)-2-(5-bromo-2,3-dimethoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one, (2Z)-2-[(5-bromo-2,3-dimethoxyphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one, 2-(5-bromo-2,3-dimethoxybenzylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
| Molecular Formula | C18H13BrN2O3S |
|---|---|
| Molecular Weight | 415.98 g/mol |
| LogP | 3.2366 |
| Topological Polar Surface Area | 52.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.98303 |
| Heavy Atoms | 25 |
| Complexity | 1212.7288 |
Chemical Identifiers
| CAS Number | 469906-35-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)/C=C\2/C(=O)N3C4=CC=CC=C4N=C3S2)Br |
Product Overview
AN-989/41262852 (CAS 469906-35-2), with molecular formula C18H13BrN2O3S and molecular weight 415.98 g/mol. IUPAC: (2Z)-2-[(5-bromo-2,3-dimethoxyphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of AN-989/41262852
Property Insights of AN-989/41262852
The XLogP value of 3.2366 indicates that AN-989/41262852 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.83 Ų, AN-989/41262852 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-989/41262852 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 AN-989/41262852?
The CAS number of AN-989/41262852 is 469906-35-2.
What is the molecular formula of AN-989/41262852?
The molecular formula of AN-989/41262852 is C18H13BrN2O3S.
What is the molecular weight of AN-989/41262852?
The molecular weight of AN-989/41262852 is 415.98 g/mol.
Where can I buy AN-989/41262852?
You can request a quote for AN-989/41262852 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-989/41262852?
Yes, KEHONG BIO provides custom synthesis services for AN-989/41262852 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.