CDS1_004126
TL;DR: CDS1_004126 (CAS 312607-92-4) is a chemical compound with molecular formula C17H18N2OS2 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CDS1_004126, BIM-0023952.P001, (5E)-5-{(2E)-3-[4-(dimethylamino)phenyl]prop-2-en-1-ylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one, (5E)-5-[(2E)-3-[4-(DIMETHYLAMINO)PHENYL]PROP-2-EN-1-YLIDENE]-3-(PROP-2-EN-1-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (5E)-5-[(E)-3-(4-dimethylaminophenyl)prop-2-enylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C17H18N2OS2 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 3.696 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.08606 |
| Heavy Atoms | 22 |
| Complexity | 645.1277 |
Chemical Identifiers
| CAS Number | 312607-92-4 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C/C=C/2\C(=O)N(C(=S)S2)CC=C |
Product Overview
CDS1_004126 (CAS 312607-92-4), with molecular formula C17H18N2OS2 and molecular weight 330.09 g/mol. IUPAC: (5E)-5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of CDS1_004126
Property Insights of CDS1_004126
The XLogP value of 3.696 indicates that CDS1_004126 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, CDS1_004126 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CDS1_004126 has 0 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 CDS1_004126?
The CAS number of CDS1_004126 is 312607-92-4.
What is the molecular formula of CDS1_004126?
The molecular formula of CDS1_004126 is C17H18N2OS2.
What is the molecular weight of CDS1_004126?
The molecular weight of CDS1_004126 is 330.09 g/mol.
Where can I buy CDS1_004126?
You can request a quote for CDS1_004126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_004126?
Yes, KEHONG BIO provides custom synthesis services for CDS1_004126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.