Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)
TL;DR: Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) (CAS 27976-23-4) is a chemical compound with molecular formula C23H25NO3S2 and molecular weight 427.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,1-diphenyl-3-(2-sulfosulfanylethylamino)propyl]benzene
Also Known As: Thiosulfuric acid, S-(2-((3,3,3-triphenylpropyl)amino)ethyl) ester, Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester), 2-(3,3,3-Triphenylpropyl)aminoethanethiol hydrogen sulfate (ester), s-{2-[(3,3,3-triphenylpropyl)amino]ethyl} hydrogen sulfurothioate, [1,1-diphenyl-3-(2-sulfosulfanylethylamino)propyl]benzene
| Molecular Formula | C23H25NO3S2 |
|---|---|
| Molecular Weight | 427.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 427.1276 |
| Heavy Atoms | 29 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 27976-23-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CCNCCSS(=O)(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | LUSHIYVPITXVAK-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) (CAS 27976-23-4), with molecular formula C23H25NO3S2 and molecular weight 427.13 g/mol. IUPAC: [1,1-diphenyl-3-(2-sulfosulfanylethylamino)propyl]benzene.
Chemical Property Profile of Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)
Property Insights of Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester). The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester). Following Lipinski's Rule of Five, Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) has 2 hydrogen bond donor(s) and 5 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 Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)?
The CAS number of Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) is 27976-23-4.
What is the molecular formula of Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)?
The molecular formula of Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) is C23H25NO3S2.
What is the molecular weight of Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)?
The molecular weight of Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) is 427.13 g/mol.
Where can I buy Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)?
You can request a quote for Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-(2-tritylethyl)amino-, hydrogen sulfate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.