Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione
TL;DR: Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione (CAS 39754-64-8) is a chemical compound with molecular formula C11H13NO2S and molecular weight 223.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(phenoxymethyl)-1,3-oxazinane-2-thione
Also Known As: Tifemoxone, Tifemoxona, Tifemoxonum, Tifemoxone [INN], Tifemoxonum [INN-Latin]
| Molecular Formula | C11H13NO2S |
|---|---|
| Molecular Weight | 223.07 g/mol |
| LogP | 1.7288 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.0667 |
| Heavy Atoms | 15 |
| Complexity | 328.61963 |
Chemical Identifiers
| CAS Number | 39754-64-8 |
|---|---|
| SMILES | C1CNC(=S)OC1COC2=CC=CC=C2 |
Product Overview
Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione (CAS 39754-64-8), with molecular formula C11H13NO2S and molecular weight 223.07 g/mol. IUPAC: 6-(phenoxymethyl)-1,3-oxazinane-2-thione.
Chemical Property Profile of Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione
Property Insights of Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione
The XLogP value of 1.7288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione. With a topological polar surface area (TPSA) of 30.49 Ų, Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione has 1 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 Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione?
The CAS number of Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione is 39754-64-8.
What is the molecular formula of Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione?
The molecular formula of Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione is C11H13NO2S.
What is the molecular weight of Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione?
The molecular weight of Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione is 223.07 g/mol.
Where can I buy Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione?
You can request a quote for Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydro-6-(phenoxymethyl)-2H-1,3-oxazine-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.