tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione
TL;DR: tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione (CAS 6746-27-6) is a chemical compound with molecular formula C4H9N3S and molecular weight 131.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-1,3,5-triazinane-2-thione
Also Known As: Triazinthion, Triazinethion, 5-Methyl-1,3,5-triazinane-2-thione, 5-methyl-1,4,5,6-tetrahydro-1,3,5-triazine-2-thiol, 5-Methylhexahydro-1,3,5-triazine-2-thione
| Molecular Formula | C4H9N3S |
|---|---|
| Molecular Weight | 131.05 g/mol |
| LogP | -0.6891 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.05171 |
| Heavy Atoms | 8 |
| Complexity | 93.45654 |
Chemical Identifiers
| CAS Number | 6746-27-6 |
|---|---|
| SMILES | CN1CNC(=S)NC1 |
Product Overview
tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione (CAS 6746-27-6), with molecular formula C4H9N3S and molecular weight 131.05 g/mol. IUPAC: 5-methyl-1,3,5-triazinane-2-thione.
Chemical Property Profile of tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione
Property Insights of tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione
The XLogP value of -0.6891 indicates that tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.3 Ų, tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione has 2 hydrogen bond donor(s) and 2 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 tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione?
The CAS number of tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione is 6746-27-6.
What is the molecular formula of tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione?
The molecular formula of tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione is C4H9N3S.
What is the molecular weight of tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione?
The molecular weight of tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione is 131.05 g/mol.
Where can I buy tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione?
You can request a quote for tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione?
Yes, KEHONG BIO provides custom synthesis services for tetrahydro-5-methyl-1,3,5-triazine-2(1H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.