AF-399/11786061
TL;DR: AF-399/11786061 (CAS 301682-04-2) is a chemical compound with molecular formula C19H12BrN3O3S2 and molecular weight 472.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5Z)-5-(5-bromo-1-methyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Also Known As: AF-399/11786061, N-[(5Z)-5-(5-bromo-1-methyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide, (Z)-N-(5-(5-bromo-1-methyl-2-oxoindolin-3-ylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzamide, N-[(5Z)-5-(5-bromo-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide, N-[5-(5-bromo-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
| Molecular Formula | C19H12BrN3O3S2 |
|---|---|
| Molecular Weight | 472.95 g/mol |
| LogP | 3.3419 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 472.95035 |
| Heavy Atoms | 28 |
| Complexity | 1085.0864 |
Chemical Identifiers
| CAS Number | 301682-04-2 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)Br)/C(=C/3\C(=O)N(C(=S)S3)NC(=O)C4=CC=CC=C4)/C1=O |
Product Overview
AF-399/11786061 (CAS 301682-04-2), with molecular formula C19H12BrN3O3S2 and molecular weight 472.95 g/mol. IUPAC: N-[(5Z)-5-(5-bromo-1-methyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide.
Chemical Property Profile of AF-399/11786061
Property Insights of AF-399/11786061
The XLogP value of 3.3419 indicates that AF-399/11786061 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/11786061. Following Lipinski's Rule of Five, AF-399/11786061 has 1 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 AF-399/11786061?
The CAS number of AF-399/11786061 is 301682-04-2.
What is the molecular formula of AF-399/11786061?
The molecular formula of AF-399/11786061 is C19H12BrN3O3S2.
What is the molecular weight of AF-399/11786061?
The molecular weight of AF-399/11786061 is 472.95 g/mol.
Where can I buy AF-399/11786061?
You can request a quote for AF-399/11786061 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/11786061?
Yes, KEHONG BIO provides custom synthesis services for AF-399/11786061 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.