4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-
TL;DR: 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- (CAS 82697-79-8) 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.
2-(4-methoxyphenyl)-1,3-thiazinan-4-one
Also Known As: 2-(4-Methoxyphenyl)-1,3-perhydrothiazine-4-one, Tetrahydro-2-(4-methoxyphenyl)-4H-1,3-thiazin-4-one, 2-(4-methoxyphenyl)-1,3-thiazinan-4-one, 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-, 2-(4-methoxy-phenyl)-[1,3]thiazinan-4-one
| Molecular Formula | C11H13NO2S |
|---|---|
| Molecular Weight | 223.07 g/mol |
| LogP | 1.9469 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.0667 |
| Heavy Atoms | 15 |
| Complexity | 350.11047 |
Chemical Identifiers
| CAS Number | 82697-79-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2NC(=O)CCS2 |
Product Overview
4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- (CAS 82697-79-8), with molecular formula C11H13NO2S and molecular weight 223.07 g/mol. IUPAC: 2-(4-methoxyphenyl)-1,3-thiazinan-4-one.
Chemical Property Profile of 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-
Property Insights of 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-
The XLogP value of 1.9469 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-. With a topological polar surface area (TPSA) of 38.33 Ų, 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- 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 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-?
The CAS number of 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- is 82697-79-8.
What is the molecular formula of 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-?
The molecular formula of 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- is C11H13NO2S.
What is the molecular weight of 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-?
The molecular weight of 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- is 223.07 g/mol.
Where can I buy 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-?
You can request a quote for 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1,3-Thiazin-4-one, tetrahydro-2-(4-methoxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.