Methyl Thiomorpholine-2-carboxylate
TL;DR: Methyl Thiomorpholine-2-carboxylate (CAS 78865-47-1) is a chemical compound with molecular formula C6H11NO2S and molecular weight 161.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl thiomorpholine-2-carboxylate
Also Known As: Methyl Thiomorpholine-2-carboxylate, MethylThiomorpholine-2-carboxylate, terahydro-1,4-thiazine carboxylic acid methyl ester, F2124-0652
| Molecular Formula | C6H11NO2S |
|---|---|
| Molecular Weight | 161.05 g/mol |
| LogP | -0.1356 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.05106 |
| Heavy Atoms | 10 |
| Complexity | 122.91622 |
Chemical Identifiers
| CAS Number | 78865-47-1 |
|---|---|
| SMILES | COC(=O)C1CNCCS1 |
Product Overview
Methyl Thiomorpholine-2-carboxylate (CAS 78865-47-1), with molecular formula C6H11NO2S and molecular weight 161.05 g/mol. IUPAC: methyl thiomorpholine-2-carboxylate.
Chemical Property Profile of Methyl Thiomorpholine-2-carboxylate
Property Insights of Methyl Thiomorpholine-2-carboxylate
The XLogP value of -0.1356 indicates that Methyl Thiomorpholine-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.33 Ų, Methyl Thiomorpholine-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl Thiomorpholine-2-carboxylate has 1 hydrogen bond donor(s) and 4 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 Methyl Thiomorpholine-2-carboxylate?
The CAS number of Methyl Thiomorpholine-2-carboxylate is 78865-47-1.
What is the molecular formula of Methyl Thiomorpholine-2-carboxylate?
The molecular formula of Methyl Thiomorpholine-2-carboxylate is C6H11NO2S.
What is the molecular weight of Methyl Thiomorpholine-2-carboxylate?
The molecular weight of Methyl Thiomorpholine-2-carboxylate is 161.05 g/mol.
Where can I buy Methyl Thiomorpholine-2-carboxylate?
You can request a quote for Methyl Thiomorpholine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl Thiomorpholine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl Thiomorpholine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.