3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione
TL;DR: 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 338417-77-9) is a chemical compound with molecular formula C9H8ClNO3S and molecular weight 244.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-1,1-dioxo-1,3-thiazolidin-4-one
Also Known As: 3-(4-chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione, 3-(4-chlorophenyl)-1,1-dioxo-1,3-thiazolidin-4-one, 4D-055, 3-(4-Chlorophenyl)-3-thiazolane-1,1,4-trione, 3-(4-Chlorophenyl)thiazolidin-4-one 1,1-dioxide
| Molecular Formula | C9H8ClNO3S |
|---|---|
| Molecular Weight | 244.99 g/mol |
| LogP | 1.0589 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.99135 |
| Heavy Atoms | 15 |
| Complexity | 494.59366 |
Chemical Identifiers
| CAS Number | 338417-77-9 |
|---|---|
| SMILES | C1C(=O)N(CS1(=O)=O)C2=CC=C(C=C2)Cl |
Product Overview
3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 338417-77-9), with molecular formula C9H8ClNO3S and molecular weight 244.99 g/mol. IUPAC: 3-(4-chlorophenyl)-1,1-dioxo-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione
Property Insights of 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione
The XLogP value of 1.0589 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione. With a topological polar surface area (TPSA) of 54.45 Ų, 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione has 0 hydrogen bond donor(s) and 3 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 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione?
The CAS number of 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione is 338417-77-9.
What is the molecular formula of 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular formula of 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione is C9H8ClNO3S.
What is the molecular weight of 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular weight of 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione is 244.99 g/mol.
Where can I buy 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione?
You can request a quote for 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-1lambda~6~,3-thiazolane-1,1,4-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.