AF-399/41545590
TL;DR: AF-399/41545590 (CAS 496040-77-8) is a chemical compound with molecular formula C19H14BrN5O3S and molecular weight 471.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-[2-[(2-hydroxy-1H-indol-3-yl)diazenyl]-4-oxo-1,3-thiazol-5-yl]acetamide
Also Known As: AF-399/41545590, N-(4-bromophenyl)-2-{(2E)-4-hydroxy-2-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-2,5-dihydro-1,3-thiazol-5-yl}acetamide, N-(4-bromophenyl)-2-[4-oxo-2-[2-(2-oxoindol-3-yl)hydrazinyl]-1,3-thiazol-5-yl]acetamide, N-(4-bromophenyl)-2-((E)-4-oxo-2-((E)-(2-oxoindolin-3-ylidene)hydrazono)thiazolidin-5-yl)acetamide, N-(4-bromophenyl)-2-{4-oxo-2-[(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazono]-1,3-thiazolidin-5-yl}acetamide
| Molecular Formula | C19H14BrN5O3S |
|---|---|
| Molecular Weight | 471.00 g/mol |
| LogP | 4.7465 |
| Topological Polar Surface Area | 119.27 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 471.00006 |
| Heavy Atoms | 29 |
| Complexity | 1156.366 |
Chemical Identifiers
| CAS Number | 496040-77-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N2)O)N=NC3=NC(=O)C(S3)CC(=O)NC4=CC=C(C=C4)Br |
Product Overview
AF-399/41545590 (CAS 496040-77-8), with molecular formula C19H14BrN5O3S and molecular weight 471.00 g/mol. IUPAC: N-(4-bromophenyl)-2-[2-[(2-hydroxy-1H-indol-3-yl)diazenyl]-4-oxo-1,3-thiazol-5-yl]acetamide.
Chemical Property Profile of AF-399/41545590
Property Insights of AF-399/41545590
The XLogP value of 4.7465 indicates that AF-399/41545590 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.27 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41545590. Following Lipinski's Rule of Five, AF-399/41545590 has 3 hydrogen bond donor(s) and 6 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-399/41545590?
The CAS number of AF-399/41545590 is 496040-77-8.
What is the molecular formula of AF-399/41545590?
The molecular formula of AF-399/41545590 is C19H14BrN5O3S.
What is the molecular weight of AF-399/41545590?
The molecular weight of AF-399/41545590 is 471.00 g/mol.
Where can I buy AF-399/41545590?
You can request a quote for AF-399/41545590 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41545590?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41545590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.