AB00112132-01
TL;DR: AB00112132-01 (CAS 429656-19-9) is a chemical compound with molecular formula C22H20N2O7S and molecular weight 456.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetamidophenyl) 2-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Also Known As: AB00112132-01, 4-(acetylamino)phenyl [(5Z)-5-(3,4-dimethoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetate, (Z)-4-acetamidophenyl 2-(5-(3,4-dimethoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate, (4-acetamidophenyl) 2-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate, (4-acetamidophenyl) 2-[5-[(3,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
| Molecular Formula | C22H20N2O7S |
|---|---|
| Molecular Weight | 456.10 g/mol |
| LogP | 3.3041 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.09912 |
| Heavy Atoms | 32 |
| Complexity | 1095.9583 |
Chemical Identifiers
| CAS Number | 429656-19-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)OC(=O)CN2C(=O)/C(=C/C3=CC(=C(C=C3)OC)OC)/SC2=O |
Product Overview
AB00112132-01 (CAS 429656-19-9), with molecular formula C22H20N2O7S and molecular weight 456.10 g/mol. IUPAC: (4-acetamidophenyl) 2-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate.
Chemical Property Profile of AB00112132-01
Property Insights of AB00112132-01
The XLogP value of 3.3041 indicates that AB00112132-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.24 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00112132-01. Following Lipinski's Rule of Five, AB00112132-01 has 1 hydrogen bond donor(s) and 8 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 AB00112132-01?
The CAS number of AB00112132-01 is 429656-19-9.
What is the molecular formula of AB00112132-01?
The molecular formula of AB00112132-01 is C22H20N2O7S.
What is the molecular weight of AB00112132-01?
The molecular weight of AB00112132-01 is 456.10 g/mol.
Where can I buy AB00112132-01?
You can request a quote for AB00112132-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00112132-01?
Yes, KEHONG BIO provides custom synthesis services for AB00112132-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.