F1004-0055
TL;DR: F1004-0055 (CAS 403829-49-2) is a chemical compound with molecular formula C19H19N3O5S2 and molecular weight 433.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
Also Known As: F1004-0055, 3-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide, (Z)-3-(5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(5-methylisoxazol-3-yl)propanamide, 3-[(5Z)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide, 3-{5-[(3,4-dimethoxyphenyl)methylene]-4-oxo-2-thioxo(1,3-thiazolidin-3-yl)}-N- (5-methylisoxazol-3-yl)propanamide
| Molecular Formula | C19H19N3O5S2 |
|---|---|
| Molecular Weight | 433.08 g/mol |
| LogP | 3.23022 |
| Topological Polar Surface Area | 93.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.0766 |
| Heavy Atoms | 29 |
| Complexity | 985.97424 |
Chemical Identifiers
| CAS Number | 403829-49-2 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)CCN2C(=O)/C(=C/C3=CC(=C(C=C3)OC)OC)/SC2=S |
Product Overview
F1004-0055 (CAS 403829-49-2), with molecular formula C19H19N3O5S2 and molecular weight 433.08 g/mol. IUPAC: 3-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide.
Chemical Property Profile of F1004-0055
Property Insights of F1004-0055
The XLogP value of 3.23022 indicates that F1004-0055 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for F1004-0055. Following Lipinski's Rule of Five, F1004-0055 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 F1004-0055?
The CAS number of F1004-0055 is 403829-49-2.
What is the molecular formula of F1004-0055?
The molecular formula of F1004-0055 is C19H19N3O5S2.
What is the molecular weight of F1004-0055?
The molecular weight of F1004-0055 is 433.08 g/mol.
Where can I buy F1004-0055?
You can request a quote for F1004-0055 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1004-0055?
Yes, KEHONG BIO provides custom synthesis services for F1004-0055 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.