BAS 00838814
TL;DR: BAS 00838814 (CAS 301680-00-2) is a chemical compound with molecular formula C20H18N2O4S2 and molecular weight 414.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide
Also Known As: BAS 00838814, N-[(5Z)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-phenylacetamide, (Z)-N-(5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2-phenylacetamide, N-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide, N-{5-[(3,4-dimethoxyphenyl)methylene]-4-oxo-2-thioxo(1,3-thiazolidin-3-yl)}-2- phenylacetamide
| Molecular Formula | C20H18N2O4S2 |
|---|---|
| Molecular Weight | 414.07 g/mol |
| LogP | 3.1789 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.0708 |
| Heavy Atoms | 28 |
| Complexity | 944.4768 |
Chemical Identifiers
| CAS Number | 301680-00-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)NC(=O)CC3=CC=CC=C3)OC |
Product Overview
BAS 00838814 (CAS 301680-00-2), with molecular formula C20H18N2O4S2 and molecular weight 414.07 g/mol. IUPAC: N-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide.
Chemical Property Profile of BAS 00838814
Property Insights of BAS 00838814
The XLogP value of 3.1789 indicates that BAS 00838814 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00838814. Following Lipinski's Rule of Five, BAS 00838814 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 BAS 00838814?
The CAS number of BAS 00838814 is 301680-00-2.
What is the molecular formula of BAS 00838814?
The molecular formula of BAS 00838814 is C20H18N2O4S2.
What is the molecular weight of BAS 00838814?
The molecular weight of BAS 00838814 is 414.07 g/mol.
Where can I buy BAS 00838814?
You can request a quote for BAS 00838814 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00838814?
Yes, KEHONG BIO provides custom synthesis services for BAS 00838814 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.