2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione
TL;DR: 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione (CAS 352349-19-0) is a chemical compound with molecular formula C9H13N3O2S and molecular weight 227.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-1,2,5-oxadiazol-3-yl)-1-morpholin-4-ylethanethione
Also Known As: Morpholine,4-[2- -1-thioxoethyl]-, 2-(4-methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione, 4-[2-(4-methyl-1,2,5-oxadiazol-3-yl)ethanethioyl]morpholine, 2-(4-methyl-1,2,5-oxadiazol-3-yl)-1-morpholin-4-yl-ethanethione, 2-(4-methyl-1,2,5-oxadiazol-3-yl)-1-morpholin-4-ylethanethione
| Molecular Formula | C9H13N3O2S |
|---|---|
| Molecular Weight | 227.07 g/mol |
| LogP | 0.58012 |
| Topological Polar Surface Area | 51.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.07285 |
| Heavy Atoms | 15 |
| Complexity | 346.8816 |
Chemical Identifiers
| CAS Number | 352349-19-0 |
|---|---|
| SMILES | CC1=NON=C1CC(=S)N2CCOCC2 |
Product Overview
2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione (CAS 352349-19-0), with molecular formula C9H13N3O2S and molecular weight 227.07 g/mol. IUPAC: 2-(4-methyl-1,2,5-oxadiazol-3-yl)-1-morpholin-4-ylethanethione.
Chemical Property Profile of 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione
Property Insights of 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione
The XLogP value of 0.58012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione. With a topological polar surface area (TPSA) of 51.39 Ų, 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione has 0 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 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione?
The CAS number of 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione is 352349-19-0.
What is the molecular formula of 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione?
The molecular formula of 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione is C9H13N3O2S.
What is the molecular weight of 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione?
The molecular weight of 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione is 227.07 g/mol.
Where can I buy 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione?
You can request a quote for 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methyl-1,2,5-oxadiazol-3-yl)-1-morpholinoethanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.