CDS1_004412
TL;DR: CDS1_004412 (CAS 300378-64-7) is a chemical compound with molecular formula C17H15N3O4S3 and molecular weight 421.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(1,3-thiazol-2-yl)acetamide
Also Known As: CDS1_004412, BIM-0023992.P001, 2-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(1,3-thiazol-2-yl)acetamide, F0207-0795, (Z)-2-(5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(thiazol-2-yl)acetamide
| Molecular Formula | C17H15N3O4S3 |
|---|---|
| Molecular Weight | 421.02 g/mol |
| LogP | 3.0002 |
| Topological Polar Surface Area | 80.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.02246 |
| Heavy Atoms | 27 |
| Complexity | 912.1524 |
Chemical Identifiers
| CAS Number | 300378-64-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CC(=O)NC3=NC=CS3)OC |
Product Overview
CDS1_004412 (CAS 300378-64-7), with molecular formula C17H15N3O4S3 and molecular weight 421.02 g/mol. IUPAC: 2-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of CDS1_004412
Property Insights of CDS1_004412
The XLogP value of 3.0002 indicates that CDS1_004412 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.76 Ų falls within the moderate polarity range, balancing permeability and solubility for CDS1_004412. Following Lipinski's Rule of Five, CDS1_004412 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 CDS1_004412?
The CAS number of CDS1_004412 is 300378-64-7.
What is the molecular formula of CDS1_004412?
The molecular formula of CDS1_004412 is C17H15N3O4S3.
What is the molecular weight of CDS1_004412?
The molecular weight of CDS1_004412 is 421.02 g/mol.
Where can I buy CDS1_004412?
You can request a quote for CDS1_004412 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_004412?
Yes, KEHONG BIO provides custom synthesis services for CDS1_004412 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.