5W-0253
TL;DR: 5W-0253 (CAS 866039-79-4) is a chemical compound with molecular formula C17H20N2OS2 and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-5-one
Also Known As: 5W-0253, (4E)-4-{[1-(2-methylpropyl)-1,2,3,4-tetrahydroquinolin-6-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-5-one, (4E)-4-[[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-5-one, 4-[(E)-(1-isobutyl-1,2,3,4-tetrahydro-6-quinolinyl)methylidene]-2-thioxo-1,3-thiazolan-5-one
| Molecular Formula | C17H20N2OS2 |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 3.584 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.1017 |
| Heavy Atoms | 22 |
| Complexity | 652.0591 |
Chemical Identifiers
| CAS Number | 866039-79-4 |
|---|---|
| SMILES | CC(C)CN1CCCC2=C1C=CC(=C2)/C=C/3\C(=O)SC(=S)N3 |
Product Overview
5W-0253 (CAS 866039-79-4), with molecular formula C17H20N2OS2 and molecular weight 332.10 g/mol. IUPAC: (4E)-4-[[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-5-one.
Chemical Property Profile of 5W-0253
Property Insights of 5W-0253
The XLogP value of 3.584 indicates that 5W-0253 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, 5W-0253 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5W-0253 has 1 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 5W-0253?
The CAS number of 5W-0253 is 866039-79-4.
What is the molecular formula of 5W-0253?
The molecular formula of 5W-0253 is C17H20N2OS2.
What is the molecular weight of 5W-0253?
The molecular weight of 5W-0253 is 332.10 g/mol.
Where can I buy 5W-0253?
You can request a quote for 5W-0253 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5W-0253?
Yes, KEHONG BIO provides custom synthesis services for 5W-0253 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.