AB00111036-01
TL;DR: AB00111036-01 (CAS 429635-48-3) is a chemical compound with molecular formula C19H15FN2O5S and molecular weight 402.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-2-[(5Z)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Also Known As: AB00111036-01, AN-989/40768611, N-(4-fluorophenyl)-2-[(5Z)-5-(3-hydroxy-4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide, N-(4-fluorophenyl)-2-[(5Z)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide, N-(4-fluorophenyl)-2-[5-(3-hydroxy-4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
| Molecular Formula | C19H15FN2O5S |
|---|---|
| Molecular Weight | 402.07 g/mol |
| LogP | 3.2149 |
| Topological Polar Surface Area | 95.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.06857 |
| Heavy Atoms | 28 |
| Complexity | 974.7893 |
Chemical Identifiers
| CAS Number | 429635-48-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=O)S2)CC(=O)NC3=CC=C(C=C3)F)O |
Product Overview
AB00111036-01 (CAS 429635-48-3), with molecular formula C19H15FN2O5S and molecular weight 402.07 g/mol. IUPAC: N-(4-fluorophenyl)-2-[(5Z)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of AB00111036-01
Property Insights of AB00111036-01
The XLogP value of 3.2149 indicates that AB00111036-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00111036-01. Following Lipinski's Rule of Five, AB00111036-01 has 2 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 AB00111036-01?
The CAS number of AB00111036-01 is 429635-48-3.
What is the molecular formula of AB00111036-01?
The molecular formula of AB00111036-01 is C19H15FN2O5S.
What is the molecular weight of AB00111036-01?
The molecular weight of AB00111036-01 is 402.07 g/mol.
Where can I buy AB00111036-01?
You can request a quote for AB00111036-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00111036-01?
Yes, KEHONG BIO provides custom synthesis services for AB00111036-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.