2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol
TL;DR: 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol (CAS 82697-77-6) is a chemical compound with molecular formula C12H15NO3S and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-1,3-thiazinan-4-one
Also Known As: 2-(3,4-Dimethoxyphenyl)-1,3-perhydrothiazine-4-one, Tetrahydro-2-(3,4-dimethoxyphenyl)-4H-1,3-thiazin-4-one, 2-(3,4-dimethoxyphenyl)-1,3-thiazinan-4-one, 4H-1,3-Thiazin-4-one, tetrahydro-2-(3,4-dimethoxyphenyl)-, 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol
| Molecular Formula | C12H15NO3S |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 1.9555 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.07727 |
| Heavy Atoms | 17 |
| Complexity | 422.21182 |
Chemical Identifiers
| CAS Number | 82697-77-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2NC(=O)CCS2)OC |
Product Overview
2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol (CAS 82697-77-6), with molecular formula C12H15NO3S and molecular weight 253.08 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-1,3-thiazinan-4-one.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol
Property Insights of 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol
The XLogP value of 1.9555 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol. With a topological polar surface area (TPSA) of 47.56 Ų, 2-(3,4-Dimethoxyphenyl)-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-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol 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 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
The CAS number of 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol is 82697-77-6.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
The molecular formula of 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol is C12H15NO3S.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
The molecular weight of 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol is 253.08 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
You can request a quote for 2-(3,4-Dimethoxyphenyl)-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-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)-5,6-dihydro-2H-1,3-thiazin-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.