AB00095595-01
TL;DR: AB00095595-01 (CAS 300559-33-5) is a chemical compound with molecular formula C17H11BrN2O3S2 and molecular weight 433.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[(5Z)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Also Known As: AB00095595-01, 2-bromo-N-[(5Z)-5-(3-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide, (Z)-2-bromo-N-(5-(3-hydroxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzamide, 2-bromo-N-[5-(3-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide, (2-bromophenyl)-N-{5-[(3-hydroxyphenyl)methylene]-4-oxo-2-thioxo(1,3-thiazolid in-3-yl)}carboxamide
| Molecular Formula | C17H11BrN2O3S2 |
|---|---|
| Molecular Weight | 433.94 g/mol |
| LogP | 3.7009 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 433.93945 |
| Heavy Atoms | 25 |
| Complexity | 914.2709 |
Chemical Identifiers
| CAS Number | 300559-33-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NN2C(=O)/C(=C/C3=CC(=CC=C3)O)/SC2=S)Br |
Product Overview
AB00095595-01 (CAS 300559-33-5), with molecular formula C17H11BrN2O3S2 and molecular weight 433.94 g/mol. IUPAC: 2-bromo-N-[(5Z)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide.
Chemical Property Profile of AB00095595-01
Property Insights of AB00095595-01
The XLogP value of 3.7009 indicates that AB00095595-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00095595-01. Following Lipinski's Rule of Five, AB00095595-01 has 2 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 AB00095595-01?
The CAS number of AB00095595-01 is 300559-33-5.
What is the molecular formula of AB00095595-01?
The molecular formula of AB00095595-01 is C17H11BrN2O3S2.
What is the molecular weight of AB00095595-01?
The molecular weight of AB00095595-01 is 433.94 g/mol.
Where can I buy AB00095595-01?
You can request a quote for AB00095595-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00095595-01?
Yes, KEHONG BIO provides custom synthesis services for AB00095595-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.