2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-
TL;DR: 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- (CAS 80784-78-7) is a chemical compound with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-propan-2-yl-1,3,5-thiadiazine-2,4-dione
Also Known As: 6-isopropyl-1,3,5-thiadiazine-2,4-dione, 6-propan-2-yl-1,3,5-thiadiazine-2,4-dione, 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-
| Molecular Formula | C6H8N2O2S |
|---|---|
| Molecular Weight | 172.03 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.03065 |
| Heavy Atoms | 11 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 80784-78-7 |
|---|---|
| SMILES | CC(C)C1=NC(=O)NC(=O)S1 |
| InChIKey | SWBZIPFYSBQFGG-UHFFFAOYSA-N |
Product Overview
2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- (CAS 80784-78-7), with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol. IUPAC: 6-propan-2-yl-1,3,5-thiadiazine-2,4-dione.
Chemical Property Profile of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-
Property Insights of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-. Following Lipinski's Rule of Five, 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- 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 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-?
The CAS number of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- is 80784-78-7.
What is the molecular formula of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-?
The molecular formula of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- is C6H8N2O2S.
What is the molecular weight of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-?
The molecular weight of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- is 172.03 g/mol.
Where can I buy 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)-?
You can request a quote for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- 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-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.