AT-057/42238843
TL;DR: AT-057/42238843 (CAS 620099-82-3) is a chemical compound with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5E)-5-[[4-(dimethylamino)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)propanamide
Also Known As: AT-057/42238843, F1463-0367, 3-[(5E)-5-{[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE}-2,4-DIOXO-1,3-THIAZOLIDIN-3-YL]-N-(2-METHYLPHENYL)PROPANAMIDE, (E)-3-(5-(4-(dimethylamino)benzylidene)-2,4-dioxothiazolidin-3-yl)-N-(o-tolyl)propanamide, 3-[(5E)-5-[(4-dimethylaminophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)propanamide
| Molecular Formula | C22H23N3O3S |
|---|---|
| Molecular Weight | 409.15 g/mol |
| LogP | 4.12612 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.14603 |
| Heavy Atoms | 29 |
| Complexity | 967.5227 |
Chemical Identifiers
| CAS Number | 620099-82-3 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CCN2C(=O)/C(=C\C3=CC=C(C=C3)N(C)C)/SC2=O |
Product Overview
AT-057/42238843 (CAS 620099-82-3), with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol. IUPAC: 3-[(5E)-5-[[4-(dimethylamino)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)propanamide.
Chemical Property Profile of AT-057/42238843
Property Insights of AT-057/42238843
The XLogP value of 4.12612 indicates that AT-057/42238843 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for AT-057/42238843. Following Lipinski's Rule of Five, AT-057/42238843 has 1 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 AT-057/42238843?
The CAS number of AT-057/42238843 is 620099-82-3.
What is the molecular formula of AT-057/42238843?
The molecular formula of AT-057/42238843 is C22H23N3O3S.
What is the molecular weight of AT-057/42238843?
The molecular weight of AT-057/42238843 is 409.15 g/mol.
Where can I buy AT-057/42238843?
You can request a quote for AT-057/42238843 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AT-057/42238843?
Yes, KEHONG BIO provides custom synthesis services for AT-057/42238843 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.