2-(3-Aminophenyl)-1-morpholin-4-ylethanethione
TL;DR: 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione (CAS 5425-46-7) is a chemical compound with molecular formula C12H16N2OS and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-aminophenyl)-1-morpholin-4-ylethanethione
Also Known As: 2-(3-aminophenyl)-1-morpholin-4-ylethanethione, SDCCGMLS-0064684.P001, Ethanethione,2-(3-aminophenyl)-1-(4-morpholinyl)-, 4-[(3-amino-phenyl)-thioacetyl]-morpholine, 2-(3-aminophenyl)-1-(morpholin-4-yl)ethanethione
| Molecular Formula | C12H16N2OS |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.09833 |
| Heavy Atoms | 16 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 5425-46-7 |
|---|---|
| SMILES | C1COCCN1C(=S)CC2=CC(=CC=C2)N |
| InChIKey | AFKZJOCDRCJVRU-UHFFFAOYSA-N |
Product Overview
2-(3-Aminophenyl)-1-morpholin-4-ylethanethione (CAS 5425-46-7), with molecular formula C12H16N2OS and molecular weight 236.10 g/mol. IUPAC: 2-(3-aminophenyl)-1-morpholin-4-ylethanethione.
Chemical Property Profile of 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione
Property Insights of 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione. Following Lipinski's Rule of Five, 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione has 1 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 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione?
The CAS number of 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione is 5425-46-7.
What is the molecular formula of 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione?
The molecular formula of 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione is C12H16N2OS.
What is the molecular weight of 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione?
The molecular weight of 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione is 236.10 g/mol.
Where can I buy 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione?
You can request a quote for 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Aminophenyl)-1-morpholin-4-ylethanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.