AB00117830-01
TL;DR: AB00117830-01 (CAS 432014-48-7) is a chemical compound with molecular formula C22H21ClN2O5S and molecular weight 460.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5E)-5-[(3-chloro-4,5-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(3,4-dimethylphenyl)acetamide
Also Known As: AB00117830-01, 2-[(5E)-5-(3-chloro-4,5-dimethoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(3,4-dimethylphenyl)acetamide, 2-[(5E)-5-[(3-chloro-4,5-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(3,4-dimethylphenyl)acetamide
| Molecular Formula | C22H21ClN2O5S |
|---|---|
| Molecular Weight | 460.09 g/mol |
| LogP | 4.64904 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.08597 |
| Heavy Atoms | 31 |
| Complexity | 1099.5491 |
Chemical Identifiers
| CAS Number | 432014-48-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CN2C(=O)/C(=C\C3=CC(=C(C(=C3)Cl)OC)OC)/SC2=O)C |
Product Overview
AB00117830-01 (CAS 432014-48-7), with molecular formula C22H21ClN2O5S and molecular weight 460.09 g/mol. IUPAC: 2-[(5E)-5-[(3-chloro-4,5-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(3,4-dimethylphenyl)acetamide.
Chemical Property Profile of AB00117830-01
Property Insights of AB00117830-01
The XLogP value of 4.64904 indicates that AB00117830-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117830-01. Following Lipinski's Rule of Five, AB00117830-01 has 1 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 AB00117830-01?
The CAS number of AB00117830-01 is 432014-48-7.
What is the molecular formula of AB00117830-01?
The molecular formula of AB00117830-01 is C22H21ClN2O5S.
What is the molecular weight of AB00117830-01?
The molecular weight of AB00117830-01 is 460.09 g/mol.
Where can I buy AB00117830-01?
You can request a quote for AB00117830-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117830-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117830-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.