5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione
TL;DR: 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione (CAS 7472-19-7) is a chemical compound with molecular formula C11H10N2O4S and molecular weight 266.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione
Also Known As: 5-benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione, 5-(BENZYLSULFANYL)-5-HYDROXY-1,3-DIAZINANE-2,4,6-TRIONE
| Molecular Formula | C11H10N2O4S |
|---|---|
| Molecular Weight | 266.04 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.03613 |
| Heavy Atoms | 18 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 7472-19-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2(C(=O)NC(=O)NC2=O)O |
| InChIKey | HDQHCIADWIJQMX-UHFFFAOYSA-N |
Product Overview
5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione (CAS 7472-19-7), with molecular formula C11H10N2O4S and molecular weight 266.04 g/mol. IUPAC: 5-benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione
Property Insights of 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione has 3 hydrogen bond donor(s) and 5 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 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione?
The CAS number of 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione is 7472-19-7.
What is the molecular formula of 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione is C11H10N2O4S.
What is the molecular weight of 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione is 266.04 g/mol.
Where can I buy 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzylsulfanyl-5-hydroxy-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.