3-Thiomorpholinone, 2-methyl-
TL;DR: 3-Thiomorpholinone, 2-methyl- (CAS 69226-20-6) is a chemical compound with molecular formula C5H9NOS and molecular weight 131.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylthiomorpholin-3-one
Also Known As: 2-methylthiomorpholin-3-one, 2-Methyl-3-thiomorpholinone, 3-Thiomorpholinone, 2-methyl-, 2-methyl-thiomorpholin-3-one, 6-isopropylpyridin-2-amine
| Molecular Formula | C5H9NOS |
|---|---|
| Molecular Weight | 131.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.04048 |
| Heavy Atoms | 8 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 69226-20-6 |
|---|---|
| SMILES | CC1C(=O)NCCS1 |
| InChIKey | JFQNETYDIXLTTR-UHFFFAOYSA-N |
Product Overview
3-Thiomorpholinone, 2-methyl- (CAS 69226-20-6), with molecular formula C5H9NOS and molecular weight 131.04 g/mol. IUPAC: 2-methylthiomorpholin-3-one.
Chemical Property Profile of 3-Thiomorpholinone, 2-methyl-
Property Insights of 3-Thiomorpholinone, 2-methyl-
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiomorpholinone, 2-methyl-. With a topological polar surface area (TPSA) of 54.4 Ų, 3-Thiomorpholinone, 2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Thiomorpholinone, 2-methyl- 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-methyl-?
The CAS number of 3-Thiomorpholinone, 2-methyl- is 69226-20-6.
What is the molecular formula of 3-Thiomorpholinone, 2-methyl-?
The molecular formula of 3-Thiomorpholinone, 2-methyl- is C5H9NOS.
What is the molecular weight of 3-Thiomorpholinone, 2-methyl-?
The molecular weight of 3-Thiomorpholinone, 2-methyl- is 131.04 g/mol.
Where can I buy 3-Thiomorpholinone, 2-methyl-?
You can request a quote for 3-Thiomorpholinone, 2-methyl- 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-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiomorpholinone, 2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.