RefChem:1078081
TL;DR: RefChem:1078081 (CAS 99541-58-9) is a chemical compound with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5E)-5-butylidene-2-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
Also Known As: N-(5-Butylidene-2-(3,4-dimethoxyphenyl)-4-oxo-3-thiazolidinyl)-2-hydroxybenzamide, Benzamide, N-(5-butylidene-2-(3,4-dimethoxyphenyl)-4-oxo-3-thiazolidinyl)-2-hydroxy-, N-[(5E)-5-butylidene-2-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide, RefChem:1078081
| Molecular Formula | C22H24N2O3S |
|---|---|
| Molecular Weight | 396.15 g/mol |
| LogP | 4.61204 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.15076 |
| Heavy Atoms | 28 |
| Complexity | 939.12915 |
Chemical Identifiers
| CAS Number | 99541-58-9 |
|---|---|
| SMILES | CCC/C=C/1\C(=O)N(C(S1)C2=CC(=C(C=C2)C)C)NC(=O)C3=CC=CC=C3O |
Product Overview
RefChem:1078081 (CAS 99541-58-9), with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol. IUPAC: N-[(5E)-5-butylidene-2-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide.
Chemical Property Profile of RefChem:1078081
Property Insights of RefChem:1078081
The XLogP value of 4.61204 indicates that RefChem:1078081 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1078081. Following Lipinski's Rule of Five, RefChem:1078081 has 2 hydrogen bond donor(s) and 4 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 RefChem:1078081?
The CAS number of RefChem:1078081 is 99541-58-9.
What is the molecular formula of RefChem:1078081?
The molecular formula of RefChem:1078081 is C22H24N2O3S.
What is the molecular weight of RefChem:1078081?
The molecular weight of RefChem:1078081 is 396.15 g/mol.
Where can I buy RefChem:1078081?
You can request a quote for RefChem:1078081 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1078081?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1078081 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.