3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one
TL;DR: 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one (CAS 865660-00-0) is a chemical compound with molecular formula C11H15NO4S and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-6-(hydroxymethyl)-2-(thiomorpholin-4-ylmethyl)pyran-4-one
Also Known As: 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one, 3-hydroxy-6-(hydroxymethyl)-2-[(thiomorpholin-4-yl)methyl]-4H-pyran-4-one, 3-hydroxy-6-(hydroxymethyl)-2-(thiomorpholin-4-ylmethyl)pyran-4-one, 3X-0383, 3-hydroxy-6-(hydroxymethyl)-2-(thiomorpholinomethyl)-4H-pyran-4-one
| Molecular Formula | C11H15NO4S |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 0.3865 |
| Topological Polar Surface Area | 73.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.07217 |
| Heavy Atoms | 17 |
| Complexity | 439.58783 |
Chemical Identifiers
| CAS Number | 865660-00-0 |
|---|---|
| SMILES | C1CSCCN1CC2=C(C(=O)C=C(O2)CO)O |
Product Overview
3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one (CAS 865660-00-0), with molecular formula C11H15NO4S and molecular weight 257.07 g/mol. IUPAC: 3-hydroxy-6-(hydroxymethyl)-2-(thiomorpholin-4-ylmethyl)pyran-4-one.
Chemical Property Profile of 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one
Property Insights of 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one
The XLogP value of 0.3865 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one. The TPSA of 73.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one. Following Lipinski's Rule of Five, 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one has 2 hydrogen bond donor(s) and 6 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-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one?
The CAS number of 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one is 865660-00-0.
What is the molecular formula of 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one?
The molecular formula of 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one is C11H15NO4S.
What is the molecular weight of 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one?
The molecular weight of 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one is 257.07 g/mol.
Where can I buy 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one?
You can request a quote for 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-hydroxy-6-(hydroxymethyl)-2-(1,4-thiazinan-4-ylmethyl)-4H-pyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.