2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione
TL;DR: 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione (CAS 26580-58-5) is a chemical compound with molecular formula C12H14BrNOS and molecular weight 299.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromophenyl)-1-morpholin-4-ylethanethione
Also Known As: 2-(3-Bromophenyl)-1-morpholinoethanethione, 2-(3-bromophenyl)-1-morpholin-4-ylethanethione, 4-[(3-bromo-phenyl)-thioacetyl]-morpholine, Thiomorpholid von m-Bromphenylessigsaeure, 2-(3-Bromophenyl)-1-(4-morpholinyl)-Ethanethione
| Molecular Formula | C12H14BrNOS |
|---|---|
| Molecular Weight | 299.00 g/mol |
| LogP | 2.6512 |
| Topological Polar Surface Area | 12.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.99796 |
| Heavy Atoms | 16 |
| Complexity | 377.03644 |
Chemical Identifiers
| CAS Number | 26580-58-5 |
|---|---|
| SMILES | C1COCCN1C(=S)CC2=CC(=CC=C2)Br |
Product Overview
2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione (CAS 26580-58-5), with molecular formula C12H14BrNOS and molecular weight 299.00 g/mol. IUPAC: 2-(3-bromophenyl)-1-morpholin-4-ylethanethione.
Chemical Property Profile of 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione
Property Insights of 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione
The XLogP value of 2.6512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione. With a topological polar surface area (TPSA) of 12.47 Ų, 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione 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-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione?
The CAS number of 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione is 26580-58-5.
What is the molecular formula of 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione?
The molecular formula of 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione is C12H14BrNOS.
What is the molecular weight of 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione?
The molecular weight of 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione is 299.00 g/mol.
Where can I buy 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione?
You can request a quote for 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Bromophenyl)-1-(morpholin-4-yl)ethane-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.