![4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione structure](/static/products/4780/478040-90-3.webp)
4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione
TL;DR: 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione (CAS 478040-90-3) is a chemical compound with molecular formula C12H14F3NO2S and molecular weight 293.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-thiazinane 1,1-dioxide
Also Known As: Bionet2_000596, 4-[3-(trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione, 4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-thiazinane 1,1-dioxide, 4-[3-(Trifluoromethyl)benzyl]-4-thiazinane-1,1-dione, 4-(3-(Trifluoromethyl)benzyl)thiomorpholine 1,1-dioxide
| Molecular Formula | C12H14F3NO2S |
|---|---|
| Molecular Weight | 293.07 g/mol |
| LogP | 1.9358 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.06973 |
| Heavy Atoms | 19 |
| Complexity | 540.3381 |
Chemical Identifiers
| CAS Number | 478040-90-3 |
|---|---|
| SMILES | C1CS(=O)(=O)CCN1CC2=CC(=CC=C2)C(F)(F)F |
Product Overview
4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione (CAS 478040-90-3), with molecular formula C12H14F3NO2S and molecular weight 293.07 g/mol. IUPAC: 4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-thiazinane 1,1-dioxide.
Chemical Property Profile of 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione
Property Insights of 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione
The XLogP value of 1.9358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione. With a topological polar surface area (TPSA) of 37.38 Ų, 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione 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 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione?
The CAS number of 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione is 478040-90-3.
What is the molecular formula of 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione?
The molecular formula of 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione is C12H14F3NO2S.
What is the molecular weight of 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione?
The molecular weight of 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione is 293.07 g/mol.
Where can I buy 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione?
You can request a quote for 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(Trifluoromethyl)benzyl]-1lambda~6~,4-thiazinane-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.