2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-
TL;DR: 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- (CAS 80784-87-8) is a chemical compound with molecular formula C11H8N2O3S and molecular weight 248.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-acetylphenyl)-1,3,5-thiadiazine-2,4-dione
Also Known As: 6-(4-acetylphenyl)-1,3,5-thiadiazine-2,4-dione, 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-
| Molecular Formula | C11H8N2O3S |
|---|---|
| Molecular Weight | 248.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.02556 |
| Heavy Atoms | 17 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 80784-87-8 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)C2=NC(=O)NC(=O)S2 |
| InChIKey | WGTPTIPTYKPZLM-UHFFFAOYSA-N |
Product Overview
2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- (CAS 80784-87-8), with molecular formula C11H8N2O3S and molecular weight 248.03 g/mol. IUPAC: 6-(4-acetylphenyl)-1,3,5-thiadiazine-2,4-dione.
Chemical Property Profile of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-
Property Insights of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-. Following Lipinski's Rule of Five, 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- 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 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-?
The CAS number of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- is 80784-87-8.
What is the molecular formula of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-?
The molecular formula of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- is C11H8N2O3S.
What is the molecular weight of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-?
The molecular weight of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- is 248.03 g/mol.
Where can I buy 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-?
You can request a quote for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(4-acetylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.