2,2,2-Trifluoro-1-phenylethyl tosylcarbamate
TL;DR: 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate (CAS 380558-69-0) is a chemical compound with molecular formula C16H14F3NO4S and molecular weight 373.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,2-trifluoro-1-phenylethyl) N-(4-methylphenyl)sulfonylcarbamate
Also Known As: 2,2,2-trifluoro-1-phenylethyl tosylcarbamate, BIM-0003441.P001, AB00084081-01, (2,2,2-trifluoro-1-phenylethyl) N-(4-methylphenyl)sulfonylcarbamate
| Molecular Formula | C16H14F3NO4S |
|---|---|
| Molecular Weight | 373.06 g/mol |
| LogP | 3.71352 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.05957 |
| Heavy Atoms | 25 |
| Complexity | 833.9336 |
Chemical Identifiers
| CAS Number | 380558-69-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OC(C2=CC=CC=C2)C(F)(F)F |
Product Overview
2,2,2-Trifluoro-1-phenylethyl tosylcarbamate (CAS 380558-69-0), with molecular formula C16H14F3NO4S and molecular weight 373.06 g/mol. IUPAC: (2,2,2-trifluoro-1-phenylethyl) N-(4-methylphenyl)sulfonylcarbamate.
Chemical Property Profile of 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate
Property Insights of 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate
The XLogP value of 3.71352 indicates that 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate. Following Lipinski's Rule of Five, 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate 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 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate?
The CAS number of 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate is 380558-69-0.
What is the molecular formula of 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate?
The molecular formula of 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate is C16H14F3NO4S.
What is the molecular weight of 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate?
The molecular weight of 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate is 373.06 g/mol.
Where can I buy 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate?
You can request a quote for 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-Trifluoro-1-phenylethyl tosylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.