2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione
TL;DR: 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione (CAS 14182-66-2) is a chemical compound with molecular formula C16H23NOS and molecular weight 277.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-tert-butylphenyl)-1-morpholin-4-ylethanethione
Also Known As: Morpholine, 4-(((p-tert-butylphenyl)thio)acetyl)-, 4-(((p-tert-Butylphenyl)thio)acetyl)morpholine, 2-(4-tert-butylphenyl)-1-(morpholin-4-yl)ethanethione, 4-[2-(4-tert-butylphenyl)ethanethioyl]morpholine, 2-(4-tert-butylphenyl)-1-morpholin-4-ylethanethione
| Molecular Formula | C16H23NOS |
|---|---|
| Molecular Weight | 277.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 44.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.15002 |
| Heavy Atoms | 19 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 14182-66-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CC(=S)N2CCOCC2 |
| InChIKey | QMEWZXJKVNVIJC-UHFFFAOYSA-N |
Product Overview
2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione (CAS 14182-66-2), with molecular formula C16H23NOS and molecular weight 277.15 g/mol. IUPAC: 2-(4-tert-butylphenyl)-1-morpholin-4-ylethanethione.
Chemical Property Profile of 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione
Property Insights of 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione
The XLogP value of 3.2 indicates that 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.6 Ų, 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione has 0 hydrogen bond donor(s) and 2 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-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione?
The CAS number of 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione is 14182-66-2.
What is the molecular formula of 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione?
The molecular formula of 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione is C16H23NOS.
What is the molecular weight of 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione?
The molecular weight of 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione is 277.15 g/mol.
Where can I buy 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione?
You can request a quote for 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(1,1-Dimethylethyl)phenyl)-1-(4-morpholinyl)ethanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.