4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde
TL;DR: 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde (CAS 6954-62-7) is a chemical compound with molecular formula C6H7N3OS2 and molecular weight 201.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde
Also Known As: Dimethyl acid phosphate, 4,6-bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde, 1,3,5-Triazine-2-carboxaldehyde,4,6-bis(methylthio)-
| Molecular Formula | C6H7N3OS2 |
|---|---|
| Molecular Weight | 201.00 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.00305 |
| Heavy Atoms | 12 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 6954-62-7 |
|---|---|
| SMILES | CSC1=NC(=NC(=N1)C=O)SC |
| InChIKey | XDIRRITVIWKVDB-UHFFFAOYSA-N |
Product Overview
4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde (CAS 6954-62-7), with molecular formula C6H7N3OS2 and molecular weight 201.00 g/mol. IUPAC: 4,6-bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde.
Chemical Property Profile of 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde
Property Insights of 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde. Following Lipinski's Rule of Five, 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde has 0 hydrogen bond donor(s) and 6 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 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde?
The CAS number of 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde is 6954-62-7.
What is the molecular formula of 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde?
The molecular formula of 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde is C6H7N3OS2.
What is the molecular weight of 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde?
The molecular weight of 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde is 201.00 g/mol.
Where can I buy 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde?
You can request a quote for 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Bis(methylsulfanyl)-1,3,5-triazine-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.