3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-
TL;DR: 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- (CAS 84609-64-3) is a chemical compound with molecular formula C15H21NO2S and molecular weight 279.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(butoxymethyl)-4-phenylthiomorpholin-3-one
Also Known As: 6-(butoxymethyl)-4-phenylthiomorpholin-3-one, 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-, 6-(butoxymethyl)-4-phenyl-3-thiomorpholinone, J1.088.921I, 6-butoxymethyl-4-phenyltetrahydro-1,4-thiazin-3-one
| Molecular Formula | C15H21NO2S |
|---|---|
| Molecular Weight | 279.13 g/mol |
| LogP | 2.9517 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.1293 |
| Heavy Atoms | 19 |
| Complexity | 396.39188 |
Chemical Identifiers
| CAS Number | 84609-64-3 |
|---|---|
| SMILES | CCCCOCC1CN(C(=O)CS1)C2=CC=CC=C2 |
Product Overview
3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- (CAS 84609-64-3), with molecular formula C15H21NO2S and molecular weight 279.13 g/mol. IUPAC: 6-(butoxymethyl)-4-phenylthiomorpholin-3-one.
Chemical Property Profile of 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-
Property Insights of 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-
The XLogP value of 2.9517 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-. With a topological polar surface area (TPSA) of 29.54 Ų, 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- has 0 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 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-?
The CAS number of 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- is 84609-64-3.
What is the molecular formula of 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-?
The molecular formula of 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- is C15H21NO2S.
What is the molecular weight of 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-?
The molecular weight of 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- is 279.13 g/mol.
Where can I buy 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-?
You can request a quote for 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiomorpholinone, 6-(butoxymethyl)-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.