2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol
TL;DR: 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol (CAS 82697-76-5) is a chemical compound with molecular formula C13H17NO4S and molecular weight 283.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4,5-trimethoxyphenyl)-1,3-thiazinan-4-one
Also Known As: 2- -1,3-perhydrothiazine-4-one, 2-(3,4,5-Trimethoxyphenyl)-1,3-perhydrothiazine-4-one, Tetrahydro-2-(3,4,5-trimethoxyphenyl)-4H-1,3-thiazin-4-one, 2-(3,4,5-trimethoxyphenyl)-1,3-thiazinan-4-one, 4H-1,3-Thiazin-4-one, tetrahydro-2-(3,4,5-trimethoxyphenyl)-
| Molecular Formula | C13H17NO4S |
|---|---|
| Molecular Weight | 283.09 g/mol |
| LogP | 1.9641 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.08783 |
| Heavy Atoms | 19 |
| Complexity | 452.70618 |
Chemical Identifiers
| CAS Number | 82697-76-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2NC(=O)CCS2 |
Product Overview
2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol (CAS 82697-76-5), with molecular formula C13H17NO4S and molecular weight 283.09 g/mol. IUPAC: 2-(3,4,5-trimethoxyphenyl)-1,3-thiazinan-4-one.
Chemical Property Profile of 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol
Property Insights of 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol
The XLogP value of 1.9641 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol. With a topological polar surface area (TPSA) of 56.79 Ų, 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol has 1 hydrogen bond donor(s) and 5 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 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
The CAS number of 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol is 82697-76-5.
What is the molecular formula of 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
The molecular formula of 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol is C13H17NO4S.
What is the molecular weight of 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
The molecular weight of 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol is 283.09 g/mol.
Where can I buy 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
You can request a quote for 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4,5-Trimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.