2,2-Dimethylthiomorpholine-3,5-dione
TL;DR: 2,2-Dimethylthiomorpholine-3,5-dione (CAS 98196-78-2) is a chemical compound with molecular formula C6H9NO2S and molecular weight 159.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylthiomorpholine-3,5-dione
Also Known As: 2,2-dimethylthiomorpholine-3,5-dione, 2,2-dimethyl-thiomorpholine-3,5-dione
| Molecular Formula | C6H9NO2S |
|---|---|
| Molecular Weight | 159.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.0354 |
| Heavy Atoms | 10 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 98196-78-2 |
|---|---|
| SMILES | CC1(C(=O)NC(=O)CS1)C |
| InChIKey | CXSYKAPYJARLPO-UHFFFAOYSA-N |
Product Overview
2,2-Dimethylthiomorpholine-3,5-dione (CAS 98196-78-2), with molecular formula C6H9NO2S and molecular weight 159.04 g/mol. IUPAC: 2,2-dimethylthiomorpholine-3,5-dione.
Chemical Property Profile of 2,2-Dimethylthiomorpholine-3,5-dione
Property Insights of 2,2-Dimethylthiomorpholine-3,5-dione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethylthiomorpholine-3,5-dione. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethylthiomorpholine-3,5-dione. Following Lipinski's Rule of Five, 2,2-Dimethylthiomorpholine-3,5-dione 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 2,2-Dimethylthiomorpholine-3,5-dione?
The CAS number of 2,2-Dimethylthiomorpholine-3,5-dione is 98196-78-2.
What is the molecular formula of 2,2-Dimethylthiomorpholine-3,5-dione?
The molecular formula of 2,2-Dimethylthiomorpholine-3,5-dione is C6H9NO2S.
What is the molecular weight of 2,2-Dimethylthiomorpholine-3,5-dione?
The molecular weight of 2,2-Dimethylthiomorpholine-3,5-dione is 159.04 g/mol.
Where can I buy 2,2-Dimethylthiomorpholine-3,5-dione?
You can request a quote for 2,2-Dimethylthiomorpholine-3,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethylthiomorpholine-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethylthiomorpholine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.