1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide
TL;DR: 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide (CAS 1174907-03-9) is a chemical compound with molecular formula C11H16IN3S and molecular weight 349.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-6-methylsulfanyl-2,4-dihydro-1H-1,3,5-triazine;hydroiodide
Also Known As: 1,2,3,6-Tetrahydro-4-(methylthio)-1-(phenylmethyl)-, 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide, 1,2,3,6-Tetrahydro-4-(methylthio)-1-(phenylmethyl)-1,3,5-triazine Hydroiodide, 3-benzyl-6-methylsulfanyl-2,4-dihydro-1H-1,3,5-triazine;hydroiodide, 3-benzyl-6-methylsulfanyl-2,4-dihydro-1H-1,3,5-triazine hydroiodide
| Molecular Formula | C11H16IN3S |
|---|---|
| Molecular Weight | 349.01 g/mol |
| LogP | 2.3438 |
| Topological Polar Surface Area | 27.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.01096 |
| Heavy Atoms | 16 |
| Complexity | 342.34274 |
Chemical Identifiers
| CAS Number | 1174907-03-9 |
|---|---|
| SMILES | CSC1=NCN(CN1)CC2=CC=CC=C2.I |
Product Overview
1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide (CAS 1174907-03-9), with molecular formula C11H16IN3S and molecular weight 349.01 g/mol. IUPAC: 3-benzyl-6-methylsulfanyl-2,4-dihydro-1H-1,3,5-triazine;hydroiodide.
Chemical Property Profile of 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide
Property Insights of 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide
The XLogP value of 2.3438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide. With a topological polar surface area (TPSA) of 27.63 Ų, 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide 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 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide?
The CAS number of 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide is 1174907-03-9.
What is the molecular formula of 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide?
The molecular formula of 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide is C11H16IN3S.
What is the molecular weight of 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide?
The molecular weight of 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide is 349.01 g/mol.
Where can I buy 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide?
You can request a quote for 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-1,2,3,6-tetrahydro-4-(methylthio)-1,3,5-triazine Hydroiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.