3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione
TL;DR: 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 109052-23-5) is a chemical compound with molecular formula C10H8F3NO3S and molecular weight 279.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dioxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
Also Known As: Bionet2_001548, 5D-167, 3-[4-(trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione, 1,1-dioxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one, 3-[4-(Trifluoromethyl)phenyl]-3-thiazolane-1,1,4-trione
| Molecular Formula | C10H8F3NO3S |
|---|---|
| Molecular Weight | 279.02 g/mol |
| LogP | 1.4243 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.0177 |
| Heavy Atoms | 18 |
| Complexity | 577.3806 |
Chemical Identifiers
| CAS Number | 109052-23-5 |
|---|---|
| SMILES | C1C(=O)N(CS1(=O)=O)C2=CC=C(C=C2)C(F)(F)F |
Product Overview
3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 109052-23-5), with molecular formula C10H8F3NO3S and molecular weight 279.02 g/mol. IUPAC: 1,1-dioxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione
Property Insights of 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione
The XLogP value of 1.4243 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione. With a topological polar surface area (TPSA) of 54.45 Ų, 3-[4-(Trifluoromethyl)phenyl]-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-(Trifluoromethyl)phenyl]-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-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione?
The CAS number of 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione is 109052-23-5.
What is the molecular formula of 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular formula of 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione is C10H8F3NO3S.
What is the molecular weight of 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular weight of 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione is 279.02 g/mol.
Where can I buy 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione?
You can request a quote for 3-[4-(Trifluoromethyl)phenyl]-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-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(Trifluoromethyl)phenyl]-1lambda~6~,3-thiazolane-1,1,4-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.