3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid
TL;DR: 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid (CAS 871548-26-4) is a chemical compound with molecular formula C8H12N2O4S and molecular weight 232.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)propanoic acid
Also Known As: 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid, 3-(3,5-Dimethyl-1,1-dioxo-1,2-dihydro-1lambda6-[1,2,6]thiadiazin-4-yl)-propionic acid, 3-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)propanoic Acid, 3-(3,5-dimethyl-1,1-dioxo-2H-1??,2,6-thiadiazin-4-yl)propanoic acid, BRD-K09944568-001-01-7
| Molecular Formula | C8H12N2O4S |
|---|---|
| Molecular Weight | 232.05 g/mol |
| LogP | 0.4341 |
| Topological Polar Surface Area | 95.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.05177 |
| Heavy Atoms | 15 |
| Complexity | 447.26212 |
Chemical Identifiers
| CAS Number | 871548-26-4 |
|---|---|
| SMILES | CC1=C(C(=NS(=O)(=O)N1)C)CCC(=O)O |
Product Overview
3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid (CAS 871548-26-4), with molecular formula C8H12N2O4S and molecular weight 232.05 g/mol. IUPAC: 3-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)propanoic acid.
Chemical Property Profile of 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid
Property Insights of 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid
The XLogP value of 0.4341 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid. The TPSA of 95.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid has 2 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 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid?
The CAS number of 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid is 871548-26-4.
What is the molecular formula of 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid?
The molecular formula of 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid is C8H12N2O4S.
What is the molecular weight of 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid?
The molecular weight of 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid is 232.05 g/mol.
Where can I buy 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid?
You can request a quote for 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,5-dimethyl-1,1-dioxido-2H-1,2,6-thiadiazin-4-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.