2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one
TL;DR: 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one (CAS 851592-49-9) is a chemical compound with molecular formula C16H27NO3S and molecular weight 313.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethyl-3-(6-morpholin-4-ylhexoxy)-2H-thiophen-5-one
Also Known As: 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one, 2,4-dimethyl-3-(6-morpholin-4-ylhexoxy)-2H-thiophen-5-one, 3,5-dimethyl-4-((6-morpholinohexyl)oxy)thiophen-2(5H)-one, 2(5H)-Thiophenone, 3,5-dimethyl-4-[[6-(4-morpholinyl)hexyl]oxy]-
| Molecular Formula | C16H27NO3S |
|---|---|
| Molecular Weight | 313.17 g/mol |
| LogP | 2.8315 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 313.17117 |
| Heavy Atoms | 21 |
| Complexity | 377.71838 |
Chemical Identifiers
| CAS Number | 851592-49-9 |
|---|---|
| SMILES | CC1C(=C(C(=O)S1)C)OCCCCCCN2CCOCC2 |
Product Overview
2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one (CAS 851592-49-9), with molecular formula C16H27NO3S and molecular weight 313.17 g/mol. IUPAC: 2,4-dimethyl-3-(6-morpholin-4-ylhexoxy)-2H-thiophen-5-one.
Chemical Property Profile of 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one
Property Insights of 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one
The XLogP value of 2.8315 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one. With a topological polar surface area (TPSA) of 38.77 Ų, 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one 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-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one?
The CAS number of 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one is 851592-49-9.
What is the molecular formula of 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one?
The molecular formula of 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one is C16H27NO3S.
What is the molecular weight of 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one?
The molecular weight of 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one is 313.17 g/mol.
Where can I buy 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one?
You can request a quote for 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dimethyl-3-(6-morpholinohexoxy)-2H-thiophen-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.