2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-
TL;DR: 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- (CAS 80784-79-8) is a chemical compound with molecular formula C10H8N2O2S and molecular weight 220.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-1,3,5-thiadiazine-2,4-dione
Also Known As: 6-benzyl-1,3,5-thiadiazine-2,4-dione, 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-
| Molecular Formula | C10H8N2O2S |
|---|---|
| Molecular Weight | 220.03 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.03065 |
| Heavy Atoms | 15 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 80784-79-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NC(=O)NC(=O)S2 |
| InChIKey | PREWKURSUZZSQV-UHFFFAOYSA-N |
Product Overview
2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- (CAS 80784-79-8), with molecular formula C10H8N2O2S and molecular weight 220.03 g/mol. IUPAC: 6-benzyl-1,3,5-thiadiazine-2,4-dione.
Chemical Property Profile of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-
Property Insights of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-. 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-(phenylmethyl)-. Following Lipinski's Rule of Five, 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- 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-(phenylmethyl)-?
The CAS number of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- is 80784-79-8.
What is the molecular formula of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-?
The molecular formula of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- is C10H8N2O2S.
What is the molecular weight of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-?
The molecular weight of 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- is 220.03 g/mol.
Where can I buy 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)-?
You can request a quote for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- 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-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3,5-Thiadiazine-2,4(3H)-dione, 6-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.