3-Thiomorpholinone, 2,2,5-trimethyl-
TL;DR: 3-Thiomorpholinone, 2,2,5-trimethyl- (CAS 69226-24-0) is a chemical compound with molecular formula C7H13NOS and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,5-trimethylthiomorpholin-3-one
Also Known As: 2,2,5-trimethylthiomorpholin-3-one, 3-Thiomorpholinone, 2,2,5-trimethyl-, 2,2,5-Trimethyl-3-thiomorpholinone, 2,2,5-trimethyl-thiomorpholin-3-one, 3-Thiomorpholinone,2,5-trimethyl-
| Molecular Formula | C7H13NOS |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.0718 |
| Heavy Atoms | 10 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 69226-24-0 |
|---|---|
| SMILES | CC1CSC(C(=O)N1)(C)C |
| InChIKey | JELOHXJORRMZNH-UHFFFAOYSA-N |
Product Overview
3-Thiomorpholinone, 2,2,5-trimethyl- (CAS 69226-24-0), with molecular formula C7H13NOS and molecular weight 159.07 g/mol. IUPAC: 2,2,5-trimethylthiomorpholin-3-one.
Chemical Property Profile of 3-Thiomorpholinone, 2,2,5-trimethyl-
Property Insights of 3-Thiomorpholinone, 2,2,5-trimethyl-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiomorpholinone, 2,2,5-trimethyl-. With a topological polar surface area (TPSA) of 54.4 Ų, 3-Thiomorpholinone, 2,2,5-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Thiomorpholinone, 2,2,5-trimethyl- has 1 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 3-Thiomorpholinone, 2,2,5-trimethyl-?
The CAS number of 3-Thiomorpholinone, 2,2,5-trimethyl- is 69226-24-0.
What is the molecular formula of 3-Thiomorpholinone, 2,2,5-trimethyl-?
The molecular formula of 3-Thiomorpholinone, 2,2,5-trimethyl- is C7H13NOS.
What is the molecular weight of 3-Thiomorpholinone, 2,2,5-trimethyl-?
The molecular weight of 3-Thiomorpholinone, 2,2,5-trimethyl- is 159.07 g/mol.
Where can I buy 3-Thiomorpholinone, 2,2,5-trimethyl-?
You can request a quote for 3-Thiomorpholinone, 2,2,5-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Thiomorpholinone, 2,2,5-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiomorpholinone, 2,2,5-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.